SCHEMBL4603300

SCHEMBL4603300

O=C(COc1c(C(=O)c2ccccc2)sc2ccccc12)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.51
PTPN1 P18031 1/20 0.51
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 2/20 0.48
LMNA P02545 1/20 0.48
SENP5 Q96HI0 4/20 0.47
SENP2 Q9HC62 4/20 0.47
SENP1 Q9P0U3 4/20 0.47
MAOB P27338 4/20 0.46
GABRA1 P14867 1/20 0.44
GABRA5 P31644 1/20 0.44
CXCR2 P25025 1/20 0.44
MAOA P21397 1/20 0.42
NPC1 O15118 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MCL1 Q07820 1/20 0.41
NOD2 Q9HC29 1/20 0.41
OGG1 O15527 1/20 0.40
CNR2 P34972 1/20 0.40

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
SCHEMBL4605718 0.94 PTPN1 (0.46) PTPN2PTPN1KMT2AALDH1A1LMNA
SCHEMBL4603123 0.93 GABRA1 (0.56) PTPN2PTPN1KMT2AALDH1A1LMNA
SCHEMBL4603697 0.93 SENP5 (0.48) PTPN2PTPN1KMT2AALDH1A1LMNA
SCHEMBL4603919 0.93 MAOB (0.57) PTPN2PTPN1KMT2AALDH1A1LMNA
SCHEMBL4604741 0.92 MAOB (0.60) PTPN2PTPN1KMT2AALDH1A1LMNA
SCHEMBL4635045 0.90 PTPN1 (0.63) PTPN2PTPN1KMT2AALDH1A1LMNA
SCHEMBL4603458 0.90 PTPN1 (0.59) PTPN2PTPN1KMT2AALDH1A1LMNA
SCHEMBL4605994 0.89 PTPN2 (0.43) PTPN2PTPN1KMT2AALDH1A1LMNA
SCHEMBL4603662 0.89 ALDH1A1 (0.51) ALDH1A1SENP5SENP2SENP1MAOB
SCHEMBL4605223 0.88 SENP5 (0.50) PTPN2PTPN1KMT2AALDH1A1LMNA

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 13 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
EP-1685122-B1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2008-07-09 EP disclosed
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

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 PTPN2 2576/4885PTPN1 2031/4885KMT2A 2846/4885

“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.