SCHEMBL523754

SCHEMBL523754

CCN(CC)CCSP(=O)(O)O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
DRD3 P35462 1/20 0.34
BLM P54132 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
FDPS P14324 3/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP8 P22894 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
LPAR1 Q92633 1/20 0.31

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
SCHEMBL10123863 0.83 BLM (0.46) MAPTDRD3BLMFDPSNPSR1
SCHEMBL29510648 0.77 GABBR2 (0.36) CHRM2CHRM4CHRM1CHRM3FDPS
SCHEMBL15434518 0.76 HTR1A (0.37) MAPTDRD3BLM
SCHEMBL29344807 0.74 MAPT (0.33) MAPT
SCHEMBL6738457 0.74 MAPT (0.48) MAPT
SCHEMBL15268543 0.73 MEN1 (0.30)
SCHEMBL121180 0.72 MEN1 (0.39)
SCHEMBL7869696 0.72 MEN1 (0.39)
SCHEMBL5054651 0.72
Alcohol SCHEMBL2319134 0.71 MEN1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220087980-A1 METHODS OF USING DANTROLENE TO TREAT NERVE AGENT EXPOSURE EAGLE PHARMACEUTICALS, INC. 2022-03-24 US claimed
EP-3678659-A1 METHODS OF USING DANTROLENE TO TREAT NERVE AGENT EXPOSURE Eagle Pharmaceuticals, Inc. (US) 2020-07-15 EP claimed
WO-2020112766-A1 COMPOSITIONS AND METHODS FOR TREATING NERVE AGENT EXPOSURE HOFFMAN STEVEN (US) 2020-06-04 WO claimed
US-20200163952-A1 COMPOSITIONS AND METHODS FOR TREATING NERVE AGENT EXPOSURE HOFFMAN STEVEN (US) 2020-05-28 US claimed
CN-111093652-A Methods of treating nerve agent exposure using dantrolene 伊格尔制药公司 2020-05-01 CN claimed
WO-2019050923-A1 METHODS OF USING DANTROLENE TO TREAT NERVE AGENT EXPOSURE EAGLE PHARMACEUTICALS, INC. (US) 2019-03-14 WO claimed
US-11547667-B2 Vaccine nanotechnology MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-01-10 US disclosed
US-11352347-B2 Dantrolene prodrugs and methods of their use Eagle Research Labs Limited (MT) 2022-06-07 US disclosed
US-20220087980-A1 METHODS OF USING DANTROLENE TO TREAT NERVE AGENT EXPOSURE EAGLE PHARMACEUTICALS, INC. 2022-03-24 US disclosed
US-20210236467-A1 DANTROLENE FORMULATIONS AND METHODS OF THEIR USE EAGLE PHARMACEUTICALS, INC. 2021-08-05 US disclosed
EP-3796889-A1 DANTROLENE FORMULATIONS AND METHODS OF THEIR USE Eagle Pharmaceuticals, Inc. (US) 2021-03-31 EP disclosed
CN-112135605-A Dantrolene formulations and methods of use thereof 伊格尔制药公司 2020-12-25 CN disclosed
US-20200383954-A1 METHODS OF USING DANTROLENE TO TREAT NERVE AGENT EXPOSURE EAGLE PHARMACEUTICALS, INC. 2020-12-10 US disclosed
US-20100183727-A1 Immunonanotherapeutics that Provide IgG Humoral Response Without T-Cell Antigen PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2010-07-22 US disclosed
US-20100129439-A1 Adjuvant Incorporation in Immunonanotherapeutics PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2010-05-27 US disclosed
US-20100129392-A1 Targeting of Antigen Presenting Cells with Immunonanotherapeutics NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-05-27 US disclosed
US-20100092425-A1 Nicotine Immunonanotherapeutics NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-04-15 US disclosed
WO-2009051837-A2 VACCINE NANOTECHNOLOGY MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2009-04-23 WO disclosed
CN-1735417-A Method of treating patients exposed to toxic chemicals BIONUMERIK PHARMACEUTICALS INC (US) 2006-02-15 CN disclosed
US-4112082-A Pharmaceutical composition for treating glaucoma and compound 1,3,2-dioxaphospheringnes The State of Israel, Prime Minister's Office, The Israel Institute for Biological Research (IL) 1978-09-05 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 (8 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-20100129392-A1 Targeting of Antigen Presenting Cells with Immunonanotherapeutics CD74, CD4, ICOS MAPT 1798/4885DRD3 2517/4885BLM 3961/4885
US-20220087980-A1 METHODS OF USING DANTROLENE TO TREAT NERVE AGENT EXPOSURE PMP22, CNTN1, SMN1; SMN2 MAPT 1073/4885DRD3 1212/4885BLM 1246/4885
US-20100129439-A1 Adjuvant Incorporation in Immunonanotherapeutics ICOS, CD47, CD4 MAPT 3576/4885DRD3 2242/4885BLM 1175/4885
US-20200383954-A1 METHODS OF USING DANTROLENE TO TREAT NERVE AGENT EXPOSURE PMP22, CNTN1, SMN1; SMN2 MAPT 1073/4885DRD3 1212/4885BLM 1246/4885
US-20210236467-A1 DANTROLENE FORMULATIONS AND METHODS OF THEIR USE SMN1; SMN2, LIPA, LCLAT1 MAPT 205/4885DRD3 770/4885BLM 1344/4885
US-20100183727-A1 Immunonanotherapeutics that Provide IgG Humoral Response Without T-Cell Antigen FCGR3B, FCGR1A, FCGR2A MAPT 1683/4885DRD3 2491/4885BLM 3578/4885
US-11352347-B2 Dantrolene prodrugs and methods of their use BID, TPMT, CES2 MAPT 1491/4885DRD3 2518/4885BLM 1708/4885
US-20100092425-A1 Nicotine Immunonanotherapeutics CD4, CD47, FCGR3B MAPT 1216/4885DRD3 160/4885BLM 3095/4885

“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.