Thiothixene

Thiothixene

SCHEMBL721093

CN1CCN(CC/C=C2\c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1.O.O.[Cl-].[Cl-].[H+].[H+]

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DRD2HTR2A

The experimentally established mechanism targets of Thiothixene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 known ✓ P14416 5/20 0.94
HTR2A known ✓ P28223 3/20 0.94
CYP3A4 P08684 6/20 0.94
LMNA P02545 6/20 0.94
DRD3 P35462 6/20 0.94
CYP2D6 P10635 5/20 0.94
HTR1A P08908 5/20 0.94
ADRA2A P08913 5/20 0.94
ADRA1A P35348 5/20 0.94
SLC6A3 Q01959 5/20 0.94
KCNH2 Q12809 5/20 0.94
HRH1 P35367 5/20 0.94
DRD1 P21728 5/20 0.94
MEN1 O00255 4/20 0.94
KMT2A Q03164 4/20 0.94
ADRA2B P18089 3/20 0.94
ADRA2C P18825 3/20 0.94
HTR2C P28335 3/20 0.94
USP2 O75604 3/20 0.94
HTR6 P50406 3/20 0.94

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Thiothixene SCHEMBL30903897 0.97 MEN1 (0.98) CYP3A4LMNADRD3CYP2D6HTR1A
Thiothixene SCHEMBL40977 0.97 MEN1 (0.98) CYP3A4LMNADRD3CYP2D6HTR1A
Thiothixene SCHEMBL782605 0.97 CYP3A4 (1.00) CYP3A4LMNADRD3CYP2D6HTR1A
Thiothixene SCHEMBL29391417 0.97 CYP3A4 (1.00) CYP3A4LMNADRD3CYP2D6HTR1A
Thiothixene SCHEMBL3715363 0.97 CYP3A4 (1.00) CYP3A4LMNADRD3CYP2D6HTR1A
Thiothixene SCHEMBL29373233 0.97 CYP3A4 (1.00) CYP3A4LMNADRD3CYP2D6HTR1A
Thiothixene SCHEMBL34305 0.97 CYP3A4 (1.00) CYP3A4LMNADRD3CYP2D6HTR1A
Thiothixene SCHEMBL718331 0.97 CYP3A4 (1.00) CYP3A4LMNADRD3CYP2D6HTR1A
Thiothixene SCHEMBL561321 0.96 MEN1 (1.00) CYP3A4LMNADRD3CYP2D6HTR1A
Thiothixene SCHEMBL8022212 0.93 CYP3A4 (0.91) CYP3A4LMNADRD3CYP2D6HTR1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160361356-A1 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR ENHANCING SURVIVABILITY OF CELLS, TISSUES, ORGANS, AND ORGANISMS FRED HUTCHINSON CANCER RESEARCH CENTER 2016-12-15 US disclosed
EP-2949212-A1 USE OF OXYGEN ANTAGONISTS FOR EX VIVO PRESERVATION OF TISSUES OR ORGANS Fred Hutchinson Cancer Research Center (US) 2015-12-02 EP disclosed
US-20150164064-A1 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN CELLS, TISSUES, ORGANS, AND ORGANISMS FRED HUTCHINSON CANCER RESEARCH CENTER 2015-06-18 US disclosed
US-8822535-B2 Methods, compositions and articles of manufacture for enhancing survivability of cells, tissues, organs, and organisms FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2014-09-02 US disclosed
CN-1901795-B Methods, compositions and devices for inducing stasis in cells, tissues, organs, and organisms HUTCHINSON FRED CANCER RES 2014-03-26 CN disclosed
EP-1879599-B1 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR ENHANCING SURVIVABILITY OF CELLS, TISSUES, ORGANS, AND ORGANISMS HUTCHINSON FRED CANCER RES (US) 2013-10-16 EP disclosed
US-20120282353-A1 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR HIF MODULATING COMPOUNDS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2012-11-08 US disclosed
US-20120052479-A1 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN TISSUES AND ORGANS ROTH MARK B (US) 2012-03-01 US disclosed
EP-2363022-A2 Use of oxygen antagonists for the therapeutic treatment of mammals Fred Hutchinson Cancer Research Center (US) 2011-09-07 EP disclosed
US-7993681-B2 Exposing isolated tissue to an oxygen antagonist, e.g., a chalcogenide reducing agent, hydrogen sulfide; controlling cellular metabolism by binding to cytochrome oxidase and inhibiting or reducing oxidative phosphorylation activity; nontoxic; preservation; tranplantations; transfusions; transportation FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2011-08-09 US disclosed
WO-2006113914-A2 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR ENHANCING SURVIVABILITY OF CELLS, TISSUES, ORGANS, AND ORGANISMS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2006-10-26 WO disclosed
EP-1689228-A2 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN CELLS Fred Hutchinson Cancer Research Center (US) 2006-08-16 EP disclosed
EP-1684579-A1 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN CELLS, TISSUES, ORGANS, AND ORGANISMS Fred Hutchinson Cancer Research Center (US) 2006-08-02 EP disclosed
EP-1684580-A2 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN TISSUES AND ORGANS Fred Hutchinson Cancer Research Center (US) 2006-08-02 EP disclosed
US-20050170019-A1 Methods, compositions and devices for inducing stasis in cells FRED HUTCHINSON CANCER RESEARCH CENTER 2005-08-04 US disclosed
US-20050147692-A1 Methods, compositions and devices for inducing stasis in tissues and organs FRED HUTCHINSON CANCER RESEARCH CENTER 2005-07-07 US disclosed
US-20050136125-A1 Methods, compositions and devices for inducing stasis in cells, tissues, organs, and organisms NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-06-23 US disclosed
WO-2005041655-A1 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN CELLS, TISSUES, ORGANS, AND ORGANISMS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2005-05-12 WO disclosed
WO-2005041656-A2 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN TISSUES AND ORGANS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2005-05-12 WO disclosed
WO-2005039291-A2 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN CELLS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2005-05-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160361356-A1 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR ENHANCING SURVIVABILITY OF CELLS, TISSUES, ORGANS, AND ORGANISMS BCL2, BAX, HSF1 DRD2 3981/4885HTR2A 1242/4885CYP3A4 3762/4885
US-20050147692-A1 Methods, compositions and devices for inducing stasis in tissues and organs HIF1A, HIF1AN, PYGL DRD2 2994/4885HTR2A 3491/4885CYP3A4 2274/4885
US-20050136125-A1 Methods, compositions and devices for inducing stasis in cells, tissues, organs, and organisms HSF1, HSP90AB1, HSP90AA1 DRD2 4261/4885HTR2A 1570/4885CYP3A4 4661/4885
US-20120282353-A1 METHODS, COMPOSITIONS AND ARTICLES OF MANUFACTURE FOR HIF MODULATING COMPOUNDS HIF1A, HIF1AN, EGLN3 DRD2 4867/4885HTR2A 2653/4885CYP3A4 4498/4885
US-20050170019-A1 Methods, compositions and devices for inducing stasis in cells PLAT, TBXA2R, THPO DRD2 3570/4885HTR2A 1569/4885CYP3A4 4066/4885
US-20150164064-A1 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN CELLS, TISSUES, ORGANS, AND ORGANISMS HSF1, HSP90AB1, HSP90AA1 DRD2 4261/4885HTR2A 1570/4885CYP3A4 4661/4885
US-20120052479-A1 METHODS, COMPOSITIONS AND DEVICES FOR INDUCING STASIS IN TISSUES AND ORGANS HIF1A, HIF1AN, PYGL DRD2 2994/4885HTR2A 3491/4885CYP3A4 2274/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.