SCHEMBL4603289

SCHEMBL4603289

N#Cc1ccc(C(=O)c2sc3ccccc3c2OCC(=O)c2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.48
MAOB P27338 1/20 0.48
SENP2 Q9HC62 10/20 0.45
SENP1 Q9P0U3 10/20 0.45
SENP5 Q96HI0 9/20 0.45
SRD5A2 P31213 1/20 0.45
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GUSB P08236 1/20 0.42
NR4A1 P22736 1/20 0.42
NR4A2 P43354 1/20 0.42
NR4A3 Q92570 1/20 0.42
EDNRA P25101 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
SCHEMBL4603662 0.92 ALDH1A1 (0.51) RAB9AMAOBSENP2SENP1SENP5
SCHEMBL4605994 0.91 PTPN2 (0.43) RAB9AMAOBSENP2SENP1SENP5
SCHEMBL4604692 0.90 SENP2 (0.50) MAOBSENP2SENP1SENP5
SCHEMBL4604069 0.89 MAOB (0.54) RAB9AMAOBSENP2SENP1SENP5
SCHEMBL4603453 0.88 PRSS12 (0.44) RAB9AMAOBSENP2SENP1SENP5
SCHEMBL4604648 0.88 SENP2 (0.42) SENP2SENP1SENP5
SCHEMBL4602746 0.87 SENP2 (0.46) RAB9AMAOBSENP2SENP1SENP5
SCHEMBL4603478 0.86 MAOB (0.51) RAB9AMAOBSENP2SENP1SENP5
SCHEMBL4605175 0.86 ESR1 (0.48) RAB9AMAOBSENP2SENP1SENP5
SCHEMBL4602915 0.86 GABRA1 (0.50) RAB9AMAOBSENP2SENP1SENP5

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 11 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-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GmbH (DE) 2006-08-02 EP claimed
WO-2005054226-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2005-06-16 WO claimed
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

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 RAB9A 4246/4885MAOB 2409/4885SENP2 4103/4885

“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.