SCHEMBL154190

SCHEMBL154190

CC1[CH]CCCCCC1C

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
KMT2A Q03164 1/20 0.31
EPHX1 P07099 1/20 0.30

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
SCHEMBL154191 1.00 CA1 (0.36) CA1CA2CA4KMT2AEPHX1
SCHEMBL10578965 0.97
SCHEMBL276136 0.89
SCHEMBL4453317 0.89
SCHEMBL25217276 0.89
SCHEMBL25223861 0.89
SCHEMBL303875 0.77
SCHEMBL10582604 0.74 CA1 (0.31) CA1CA2CA4
SCHEMBL15121454 0.72
SCHEMBL864234 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023147312-A1 AMPK AGONISTS AND METHODS OF USE THEREOF EVVIA THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
WO-2020123250-A1 CANNABINOID DERIVATIVES AND METHODS FOR THEIR PREPARATION HEANEY JOHN (US) 2020-06-18 WO disclosed
US-20200179330-A1 CANNABINOID DERIVATIVES AND METHODS FOR THEIR PREPARATION HEANEY JOHN (US) 2020-06-11 US disclosed
US-20150150819-A1 COMPOSITIONS CONTAINING OPIOID ANTAGONISTS MERCK SHARP & DOHME CORP. 2015-06-04 US disclosed
US-20150126554-A1 METHODS OF PREVENTING AND TREATING GASTROINTESTINAL DYSFUNCTION ADOLOR CORPORATION 2015-05-07 US disclosed
US-8946262-B2 Methods of preventing and treating gastrointestinal dysfunction ADOLOR CORPORATION (US) 2015-02-03 US disclosed
US-8895560-B2 Opioid antagonists ADOLOR CORPORATION (US) 2014-11-25 US disclosed
US-20140303211-A1 COMPOSITIONS CONTAINING OPIOID ANTAGONISTS MERCK SHARP & DOHME CORP. 2014-10-09 US disclosed
US-20140186951-A1 NOVEL OPIOID ANTAGONISTS ADOLOR CORPORATION (US) 2014-07-03 US disclosed
US-20140057947-A1 COMPOSITIONS CONTAINING OPIOID ANTAGONISTS ADOLOR CORPORATION (US) 2014-02-27 US disclosed
US-20050054630-A1 Fused bicyclic carboxamide derivatives and methods of their use CUBIST PHARMACEUTICALS, INC. 2005-03-10 US disclosed
US-6852713-B2 Lactam derivatives and methods of their use ADOLOR CORPORATION (US) 2005-02-08 US disclosed
WO-2005004796-A2 SULFONYLAMINO PHENYLACETAMIDE DERIVATIVES AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2005-01-20 WO disclosed
WO-2004112704-A2 SUBSTITUTED PIPERIDINE COMPOUNDS AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2004-12-29 WO disclosed
US-20040254156-A1 Sulfonylamino phenylacetamide derivatives and methods of their use CALIXA THERAPEUTICS, INC. 2004-12-16 US disclosed
US-20040254218-A1 Substituted piperidine compounds and methods of their use CUBIST PHARMACEUTICALS, INC. 2004-12-16 US disclosed
WO-2004093796-A2 LACTAM DERIVATIVES AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2004-11-04 WO disclosed
US-20040209857-A1 Lactam derivatives and methods of their use ADOLOR CORPORATION 2004-10-21 US disclosed
WO-2004082623-A2 SUBSTITUTED PIPERIDINE COMPOUNDS ADOLOR CORPORATION (US) 2004-09-30 WO disclosed
US-20040186135-A1 Substituted piperidine compounds CUBIST PHARMACEUTICALS, INC. 2004-09-23 US 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 (11 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-20140057947-A1 COMPOSITIONS CONTAINING OPIOID ANTAGONISTS OPRK1, OPRL1, OPRM1 CA1 3262/4885CA2 3253/4885CA4 3931/4885
US-20040254218-A1 Substituted piperidine compounds and methods of their use OPRM1, OPRK1, OPRD1 CA1 4527/4885CA2 3989/4885CA4 4275/4885
US-20040186135-A1 Substituted piperidine compounds OPRK1, OPRD1, OPRM1 CA1 4687/4885CA2 4304/4885CA4 4536/4885
US-20040254156-A1 Sulfonylamino phenylacetamide derivatives and methods of their use CYP2E1, CYP2D6, CYP3A43 CA1 2538/4885CA2 1540/4885CA4 2832/4885
US-20150126554-A1 METHODS OF PREVENTING AND TREATING GASTROINTESTINAL DYSFUNCTION VIP, FABP2, SI CA1 1427/4885CA2 2030/4885CA4 2340/4885
US-20140303211-A1 COMPOSITIONS CONTAINING OPIOID ANTAGONISTS OPRK1, OPRL1, OPRM1 CA1 3262/4885CA2 3253/4885CA4 3931/4885
US-20150150819-A1 COMPOSITIONS CONTAINING OPIOID ANTAGONISTS OPRK1, OPRM1, OPRD1 CA1 4326/4885CA2 4561/4885CA4 4573/4885
US-20040209857-A1 Lactam derivatives and methods of their use MRPL21, SI, PEPD CA1 1801/4885CA2 3874/4885CA4 2495/4885
US-20050054630-A1 Fused bicyclic carboxamide derivatives and methods of their use PAICS, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CPS1 CA1 500/4885CA2 636/4885CA4 465/4885
US-20200179330-A1 CANNABINOID DERIVATIVES AND METHODS FOR THEIR PREPARATION CNR2, CNR1, GPR119 CA1 3507/4885CA2 2473/4885CA4 3219/4885
US-20140186951-A1 NOVEL OPIOID ANTAGONISTS OPRK1, OPRM1, OPRL1 CA1 3819/4885CA2 3039/4885CA4 3754/4885

“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.