SCHEMBL4607131

SCHEMBL4607131

COCC(Oc1c(C(C)=O)sc2ccccc12)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
MAPT P10636 3/20 0.47
F2 P00734 1/20 0.47
ALDH1A1 P00352 5/20 0.42
LMNA P02545 3/20 0.42
MAPK1 P28482 1/20 0.41
CXCR2 P25025 1/20 0.41
GAA P10253 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
EDNRA P25101 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
GLA P06280 1/20 0.40
ALOX15 P16050 1/20 0.40
ATM Q13315 1/20 0.40
PTPN1 P18031 4/20 0.39
ALOX5 P09917 1/20 0.39
SENP5 Q96HI0 3/20 0.39
SENP2 Q9HC62 3/20 0.39

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
SCHEMBL4604072 0.88 MAOB (0.46) KMT2AMAPTALDH1A1LMNAMAPK1
SCHEMBL4605028 0.87 KMT2A (0.49) KMT2AMAPTF2ALDH1A1LMNA
SCHEMBL4605156 0.85 KMT2A (0.47) KMT2AMAPTF2ALDH1A1LMNA
SCHEMBL4605521 0.83 MAOB (0.45) KMT2AMAPTALDH1A1LMNAMAPK1
SCHEMBL4603622 0.83 PTPN1 (0.52) KMT2AMAPTF2ALDH1A1LMNA
SCHEMBL4632969 0.81 SENP5 (0.41) ALDH1A1CXCR2HPGDHSD17B10KDM4E
SCHEMBL4633966 0.79 ABCC1 (0.43) KMT2AALDH1A1GAAHPGDMEN1
SCHEMBL4604924 0.79 KMT2A (0.46) KMT2AMAPTALDH1A1LMNAMAPK1
SCHEMBL4633962 0.78 ALDH1A1 (0.47) KMT2AALDH1A1MAPK1CXCR2HPGD
SCHEMBL9603073 0.76 MAPT (0.59) KMT2AMAPTF2ALDH1A1LMNA

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 3 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 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

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 KMT2A 2846/4885MAPT 1767/4885F2 418/4885

“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.