SCHEMBL4605156

SCHEMBL4605156

CCCC(Oc1c(C(C)=O)sc2ccccc12)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MAPT P10636 2/20 0.47
F2 P00734 1/20 0.47
PPARG P37231 2/20 0.47
PPARA Q07869 2/20 0.47
LMNA P02545 3/20 0.44
ALDH1A1 P00352 2/20 0.44
NOD2 Q9HC29 1/20 0.40
PTPN1 P18031 5/20 0.40
EDNRA P25101 1/20 0.40
SENP5 Q96HI0 3/20 0.39
SENP2 Q9HC62 3/20 0.39
SENP1 Q9P0U3 3/20 0.39
USP2 O75604 1/20 0.39
CXCR2 P25025 1/20 0.38
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPK1 P28482 1/20 0.38
CD274 Q9NZQ7 1/20 0.38

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
SCHEMBL4605028 0.90 KMT2A (0.49) KMT2AMAPTF2PPARGPPARA
SCHEMBL4603622 0.88 PTPN1 (0.52) KMT2AMAPTF2PPARGPPARA
SCHEMBL4605351 0.88 ALDH1A1 (0.48) KMT2APPARGPPARALMNAALDH1A1
SCHEMBL4606177 0.87 PPARG (0.44) KMT2AMAPTPPARGPPARALMNA
SCHEMBL4633994 0.87 PPARG (0.44) KMT2AMAPTPPARGPPARALMNA
SCHEMBL4607131 0.85 KMT2A (0.47) KMT2AMAPTF2LMNAALDH1A1
SCHEMBL4607155 0.83 GABRA1 (0.51) KMT2APPARGPPARALMNAALDH1A1
SCHEMBL4603775 0.83 MAOB (0.42) KMT2AMAPTPPARGPPARALMNA
SCHEMBL4633856 0.81 SENP5 (0.42) KMT2AMAPTPPARGPPARALMNA
SCHEMBL4634461 0.79 ABCC1 (0.43) KMT2AMAPTPPARGPPARALMNA

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.