SCHEMBL6476353

SCHEMBL6476353

O=C(O)C(Cc1ccccc1)c1cccc(-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.54
PSEN1 P49768 2/20 0.53
PSEN2 P49810 2/20 0.53
APH1B Q8WW43 2/20 0.53
NCSTN Q92542 2/20 0.53
APH1A Q96BI3 2/20 0.53
PSENEN Q9NZ42 2/20 0.53
ACP3 P15309 2/20 0.52
MGLL Q99685 1/20 0.50
HDAC4 P56524 1/20 0.49
PPARG P37231 4/20 0.49
PPARA Q07869 3/20 0.49
FPR2 P25090 1/20 0.48
PTPN1 P18031 1/20 0.47
GPR34 Q9UPC5 1/20 0.47
KIF11 P52732 1/20 0.46
KIFC1 Q9BW19 1/20 0.46
AGXT P21549 1/20 0.46
EPHX2 P34913 1/20 0.46

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
SCHEMBL6472838 0.88 PSEN1 (0.55) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL28858320 0.85 ACP3 (0.63) ACP3PPARGPPARAEPHX2
SCHEMBL6475463 0.84 PSEN1 (0.59) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL28209100 0.83 PPARG (0.58) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6477508 0.83 PSEN1 (0.54) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL6472107 0.82 PSEN1 (0.79) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL6472632 0.82 PSEN1 (0.63) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL6472628 0.82 PSEN1 (0.63) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL6473844 0.80 PSEN1 (0.52) FFAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL6477785 0.79 PSEN1 (0.54) FFAR1PSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005110963-A1 (BIPHENYL-3-YL)-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF AND THEIR USE IN THERAPY CELLZOME AG (DE) 2005-11-24 WO claimed
WO-2005110963-A1 (BIPHENYL-3-YL)-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF AND THEIR USE IN THERAPY CELLZOME AG (DE) 2005-11-24 WO disclosed