SCHEMBL8675834

SCHEMBL8675834

Cc1cccc(C)c1COc1ccc(C(=O)NC(CCOc2ccccc2)C(=O)O)c(C)c1C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.41
FNTB P49356 4/20 0.41
GRM2 Q14416 1/20 0.40
ITGB3 P05106 3/20 0.39
ITGB1 P05556 3/20 0.39
ITGAV P06756 3/20 0.39
ITGA5 P08648 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
SGMS2 Q8NHU3 1/20 0.38
PTGES O14684 3/20 0.37
ALOX5 P09917 3/20 0.37
PPARG P37231 3/20 0.37
PPARA Q07869 3/20 0.37
SLC22A12 Q96S37 1/20 0.37
PYGL P06737 1/20 0.37

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
SCHEMBL8676384 0.85 GPR132 (0.43) FNTAFNTB
SCHEMBL8679794 0.85 PPARG (0.43) FNTAFNTBGRM2TDP1L3MBTL1
SCHEMBL8679534 0.84 PTPN1 (0.46) FNTAFNTBITGB3ITGB1ITGAV
SCHEMBL8561807 0.84 TDP1 (0.48) FNTAFNTBITGB3ITGB1ITGAV
SCHEMBL8679817 0.84 GRM2 (0.43) GRM2ITGB3ITGB1ITGAVITGA5
SCHEMBL8677140 0.83 SRD5A2 (0.45) FNTAFNTBGRM2ITGB3TDP1
SCHEMBL8676560 0.83 FNTA (0.41) FNTAFNTBITGB1TDP1L3MBTL1
SCHEMBL8678019 0.83 PPARG (0.45) FNTAFNTBGRM2TDP1L3MBTL1
SCHEMBL8678028 0.83 GRM2 (0.45) GRM2ITGB3PTGESALOX5PPARG
SCHEMBL8678794 0.82 GRM2 (0.47) GRM2ITGB3ITGB1PTGESALOX5

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5753641-A SYNERGISTIC THERAPY COMPRISING FINASTERIDE AND TERAZOSIN DRUGS MERCK & CO., INC. (US) 1998-05-19 US disclosed