SCHEMBL9045392

SCHEMBL9045392

[CH2]CCCc1c(F)cccc1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALB P02768 1/20 0.49
HMGB1 P09429 1/20 0.39
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
BCHE P06276 1/20 0.39
GPR52 Q9Y2T5 1/20 0.38
ALDH1A1 P00352 3/20 0.38
ALOX15 P16050 2/20 0.38
KDM4E B2RXH2 2/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PTPN1 P18031 1/20 0.37
ERCC5 P28715 1/20 0.37
FEN1 P39748 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
NOTUM Q6P988 1/20 0.36
FOLH1 Q04609 1/20 0.35
TTR P02766 1/20 0.35

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
SCHEMBL9046816 0.85 KMT2A (0.41) ALBCES2CES1BCHEGPR52
SCHEMBL9045316 0.81 HPGD (0.50) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL31289 0.81 ALB (0.53) ALBHMGB1CES2CES1BCHE
SCHEMBL9046401 0.80 TSHR (0.50) CES2CES1ALDH1A1ALOX15KDM4E
SCHEMBL6130256 0.80 TAAR1 (0.42) CES2CES1ALDH1A1KDM4E
SCHEMBL9046010 0.80 ALB (0.45) ALBHMGB1CES2CES1BCHE
SCHEMBL9047115 0.79 CLCN2 (0.45) HMGB1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL16429101 0.78 ALB (0.59) ALBHMGB1CES2CES1BCHE
SCHEMBL3656083 0.77 ALB (0.57) ALBHMGB1CES2CES1BCHE
SCHEMBL16559363 0.77 ALB (0.49) ALBHMGB1CES2CES1ALDH1A1

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-0690854-A1 1-PHENYL-IMIDAZOL-2-ONE BIPHENYLMETHYL COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1996-01-10 EP claimed
EP-0690854-A1 1-PHENYL-IMIDAZOL-2-ONE BIPHENYLMETHYL COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1996-01-10 EP disclosed
EP-0664802-A1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1995-08-02 EP disclosed