SCHEMBL2961933

SCHEMBL2961933

CCOc1ccccc1C(C)CC(=O)Nc1sc2c(c1C#N)CCN(C(=O)CCc1ccncc1)C2

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.49
KMT2A Q03164 6/20 0.49
L3MBTL1 Q9Y468 2/20 0.46
MAPK10 P53779 2/20 0.44
MAPK9 P45984 1/20 0.44
STAT3 P40763 2/20 0.43
GRM1 Q13255 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL2961952 1.00 MEN1 (0.49) MEN1KMT2AL3MBTL1MAPK10MAPK9
SCHEMBL2970508 0.94 MEN1 (0.50) MEN1KMT2AL3MBTL1MAPK10MAPK9
SCHEMBL2970511 0.94 MEN1 (0.50) MEN1KMT2AL3MBTL1MAPK10MAPK9
SCHEMBL2962113 0.93 MEN1 (0.54) MEN1KMT2AL3MBTL1MAPK10MAPK9
SCHEMBL2962111 0.93 MEN1 (0.54) MEN1KMT2AL3MBTL1MAPK10MAPK9
SCHEMBL2965623 0.93 MEN1 (0.49) MEN1KMT2AL3MBTL1MAPK10MAPK9
SCHEMBL2965625 0.93 MEN1 (0.49) MEN1KMT2AL3MBTL1MAPK10MAPK9
SCHEMBL2893600 0.90 MEN1 (0.48) MEN1KMT2AL3MBTL1MAPK10STAT3
SCHEMBL3348316 0.90 L3MBTL1 (0.49) MEN1KMT2AL3MBTL1STAT3GRM1
SCHEMBL3348320 0.90 L3MBTL1 (0.49) MEN1KMT2AL3MBTL1STAT3GRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763728-B2 Tetrahydropyridothiophenes 4SC AG (DE) 2010-07-27 US claimed
US-20090257977-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES PEKARI KLAUS 2009-10-15 US claimed
US-20080260749-A1 Novel Tetrahydropyridothiophenes NYCOMED GMBH (DE) 2008-10-23 US claimed
EP-1893618-A2 TETRAHYDROPYRIDOTHIOPHENES FOR USE IN THE TREATMENT OF CANCER Nycomed GmbH (DE) 2008-03-05 EP claimed
WO-2006125815-A2 TETRAHYDROPYRIDOTHIOPHENES FOR USE IN THE TREATMENT OF CANCER NYCOMED GMBH (DE) 2006-11-30 WO claimed
CN-114096525-A Biaryl compounds, pharmaceutical compositions containing them, processes for their preparation and their use 四川科伦博泰生物医药股份有限公司 2022-02-25 CN disclosed
CN-114096533-A Tricyclic compound, pharmaceutical composition containing same, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2022-02-25 CN disclosed
CN-110678500-A Photo-or thermosetting method and curable resin composition 富士胶片和光纯药株式会社 2020-01-10 CN disclosed
US-7771919-B2 High refractive index fluids for immersion lithography E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-08-10 US disclosed
US-7763728-B2 Tetrahydropyridothiophenes 4SC AG (DE) 2010-07-27 US disclosed
US-7763728-B2 Tetrahydropyridothiophenes 4SC AG (DE) 2010-07-27 US disclosed
US-7763728-B2 Tetrahydropyridothiophenes 4SC AG (DE) 2010-07-27 US disclosed
US-20080061248-A1 High Refractive Index Fluids for Immersion Lithography E. I. DU PONT DE NEMOURS AND COMPANY 2008-03-13 US disclosed
US-20080063990-A1 High Refractive Index Fluids for Immersion Lithography HONEYWELL INTERNATIONAL, INC. (US) 2008-03-13 US disclosed
EP-1893618-A2 TETRAHYDROPYRIDOTHIOPHENES FOR USE IN THE TREATMENT OF CANCER Nycomed GmbH (DE) 2008-03-05 EP disclosed
WO-2006125815-A2 TETRAHYDROPYRIDOTHIOPHENES FOR USE IN THE TREATMENT OF CANCER NYCOMED GMBH (DE) 2006-11-30 WO disclosed
US-20060122164-A1 Carboxylic acid esters of pharmaceutical compounds ASCHER GERD 2006-06-08 US disclosed
EP-1590354-A2 CARBOXYLIC ACID ESTERS OF PHARMACEUTICAL COMPOUNDS Sandoz AG (CH) 2005-11-02 EP disclosed
WO-2004067536-A2 CARBOXYLIC ACID ESTERS TO IMPROVE BIOAVAILABILITY OF PHARMACEUTICAL COMPOUNDS SANDOZ AG (CH) 2004-08-12 WO disclosed
US-5241017-A THIONYL PHOSPHAZENE POLYMERS BAYER AKTIENGESELLSCHAFT (DE) 1993-08-31 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 (3 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-20090257977-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES BAX, BCL2, CCAR2 MEN1 4735/4885KMT2A 2418/4885L3MBTL1 2312/4885
US-20080260749-A1 Novel Tetrahydropyridothiophenes BAX, BCL2, CCAR2 MEN1 4691/4885KMT2A 2644/4885L3MBTL1 2416/4885
US-20060122164-A1 Carboxylic acid esters of pharmaceutical compounds MCCC2, HCAR2, CA7 MEN1 2198/4885KMT2A 2357/4885L3MBTL1 4829/4885

“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.