SCHEMBL4603453

SCHEMBL4603453

N#Cc1ccc(C(=O)c2sc3ccccc3c2OCC(=O)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS12 P56730 1/20 0.44
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
ESR1 P03372 2/20 0.41
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
MAOB P27338 2/20 0.39
CXCR2 P25025 1/20 0.38
PDE10A Q9Y233 1/20 0.38
CNR1 P21554 2/20 0.38
CNR2 P34972 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ABCB1 P08183 1/20 0.38
HPGD P15428 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRA5 P31644 1/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL4605994 0.95 PTPN2 (0.43) PRSS12MAPTLMNAESR1PTPN2
SCHEMBL4605718 0.90 PTPN1 (0.46) MAPTLMNAPTPN2PTPN1MAOB
SCHEMBL4602915 0.90 GABRA1 (0.50) PRSS12MAPTLMNAESR1PTPN2
SCHEMBL4603478 0.90 MAOB (0.51) MAPTLMNAPTPN2PTPN1MAOB
SCHEMBL4605175 0.90 ESR1 (0.48) MAPTLMNAESR1PTPN2PTPN1
SCHEMBL4604069 0.89 MAOB (0.54) MAPTESR1MAOBCNR1CNR2
SCHEMBL4603289 0.88 RAB9A (0.48) MAPTMAOBSMN1; SMN2RAB9ASENP5
SCHEMBL4604727 0.86 SENP5 (0.44) PRSS12MAPTLMNAESR1PTPN1
SCHEMBL4603300 0.84 PTPN2 (0.51) LMNAPTPN2PTPN1MAOBCXCR2
SCHEMBL4604300 0.84 RAB9A (0.49) LMNAMAOBCNR1CNR2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685122-B1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2008-07-09 EP claimed
US-7371774-B2 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2008-05-13 US claimed
US-20070066680-A1 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2007-03-22 US claimed
EP-1685122-B1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2008-07-09 EP disclosed
US-7371774-B2 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2008-05-13 US disclosed
US-7371774-B2 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2008-05-13 US disclosed
US-7371774-B2 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2008-05-13 US disclosed
US-20070066680-A1 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2007-03-22 US disclosed
US-20070066680-A1 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2007-03-22 US disclosed
US-20070066680-A1 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2007-03-22 US disclosed
EP-1685122-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GmbH (DE) 2006-08-02 EP disclosed
WO-2005054226-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2005-06-16 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 (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-20070066680-A1 Benzofurans and benzothiophenes INSR, GPR119, IGF1R PRSS12 672/4885MAPT 1767/4885LMNA 2810/4885

“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.