SCHEMBL5260010

SCHEMBL5260010

CCc1cc2c(C(=O)O)c(-c3ccc(F)cc3)oc2cc1N(C)S(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 4/20 0.48
CACNA1C Q13936 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
RECQL P46063 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL2843904 0.89 CACNA1C (0.54) CACNA1C
SCHEMBL2402437 0.86 ANO1 (0.46) ANO1CACNA1C
SCHEMBL2401981 0.84 CACNA1C (0.50) CACNA1C
SCHEMBL3398513 0.84 CACNA1C (0.51) CACNA1C
SCHEMBL2841366 0.82 ANO1 (0.48) ANO1CACNA1C
SCHEMBL12337485 0.82 CACNA1C (0.52) CACNA1C
SCHEMBL2470966 0.81 CACNA1C (0.49) CACNA1C
SCHEMBL2839136 0.80 ANO1 (0.59) ANO1
SCHEMBL14764441 0.79 CACNA1C (0.54) CACNA1C
SCHEMBL5258293 0.78 ANO1 (0.47) ANO1KDM4EALDH1A1HPGDMAPK1

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-1581207-A4 BENZOFURAN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT AND PROPHYLAXIS OF HEPATITIS C VIRAL INFECTIONS AND ASSOCIATED DISEASES VIROPHARMA INC (US) 2007-07-25 EP disclosed
EP-1581207-A2 BENZOFURAN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT AND PROPHYLAXIS OF HEPATITIS C VIRAL INFECTIONS AND ASSOCIATED DISEASES Viropharma Incorporated (US) 2005-10-05 EP disclosed
WO-2004041201-A2 BENZOFURAN COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATMENT AND PROPHYLAXIS OF HEPATITIS C VIRAL INFECTIONS AND ASSOCIATED DISEASES VIROPHARMA INCORPORATED (US) 2004-05-21 WO disclosed