SCHEMBL4633007

SCHEMBL4633007

CCOC(=O)c1sc2ccccc2c1OCc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.55
LMNA P02545 3/20 0.55
ALDH1A1 P00352 2/20 0.55
NOD2 Q9HC29 1/20 0.53
MAPT P10636 4/20 0.50
GAA P10253 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TP53 P04637 3/20 0.46
SENP5 Q96HI0 8/20 0.44
SENP2 Q9HC62 8/20 0.44
SENP1 Q9P0U3 8/20 0.44
USP2 O75604 1/20 0.43
NMT1 P30419 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL4633569 0.88 KMT2A (0.56) KMT2ALMNAALDH1A1NOD2MAPT
SCHEMBL4632958 0.87 KDM4E (0.51) ALDH1A1SENP5SENP2SENP1USP2
SCHEMBL4633939 0.87 MAPT (0.60) KMT2ALMNAALDH1A1NOD2MAPT
SCHEMBL4635063 0.87 ALDH1A1 (0.44) KMT2ALMNAALDH1A1NOD2MAPT
SCHEMBL4632949 0.87 KMT2A (0.69) KMT2ALMNAALDH1A1NOD2MAPT
SCHEMBL4633875 0.86 ALDH1A1 (0.67) KMT2ALMNAALDH1A1NOD2MAPT
SCHEMBL4633931 0.84 KMT2A (0.59) KMT2ALMNAALDH1A1NOD2MAPT
SCHEMBL4605877 0.84 SENP5 (0.48) SENP5SENP2SENP1USP2TRPM8
SCHEMBL4632990 0.83 ALDH1A1 (0.57) KMT2ALMNAALDH1A1NOD2MAPT
SCHEMBL4634996 0.83 KMT2A (0.64) KMT2ALMNAALDH1A1NOD2MAPT

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685121-B1 ANTIDIABETIC COMPOUNDS COMPRISING BENZOTHIOPHENE DERIVATIVES MERCK PATENT GMBH (DE) 2008-06-11 EP claimed
US-7375130-B2 Antidiabetic compounds comprising benzofuran and benzothiophene derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-05-20 US claimed
US-20070078178-A1 Antidiabetic compounds comprising benzofuran and benzothiophene derivatives MERCK PATENT GMBH (DE) 2007-04-05 US claimed
EP-1685121-B1 ANTIDIABETIC COMPOUNDS COMPRISING BENZOTHIOPHENE DERIVATIVES MERCK PATENT GMBH (DE) 2008-06-11 EP disclosed
US-7375130-B2 Antidiabetic compounds comprising benzofuran and benzothiophene derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-05-20 US disclosed
US-7375130-B2 Antidiabetic compounds comprising benzofuran and benzothiophene derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-05-20 US disclosed
US-7375130-B2 Antidiabetic compounds comprising benzofuran and benzothiophene derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-05-20 US disclosed
US-20070078178-A1 Antidiabetic compounds comprising benzofuran and benzothiophene derivatives MERCK PATENT GMBH (DE) 2007-04-05 US disclosed
US-20070078178-A1 Antidiabetic compounds comprising benzofuran and benzothiophene derivatives MERCK PATENT GMBH (DE) 2007-04-05 US disclosed
US-20070078178-A1 Antidiabetic compounds comprising benzofuran and benzothiophene derivatives MERCK PATENT GMBH (DE) 2007-04-05 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 (1 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-20070078178-A1 Antidiabetic compounds comprising benzofuran and benzothiophene derivatives GPR119, INSR, GLP1R KMT2A 3455/4885LMNA 3220/4885ALDH1A1 668/4885

“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.