SCHEMBL9673186

SCHEMBL9673186

ICCCc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.55
LTA4H P09960 7/20 0.53
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
CASP1 P29466 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TSHR P16473 1/20 0.48
PLAAT3 P53816 1/20 0.48
PLAAT5 Q96KN8 1/20 0.48
PLAAT2 Q9NWW9 1/20 0.48
PLAAT4 Q9UL19 1/20 0.48
SRD5A2 P31213 2/20 0.47
FDFT1 P37268 1/20 0.47
PPARG P37231 1/20 0.47
FFAR4 Q5NUL3 1/20 0.46
EPHX2 P34913 1/20 0.46
NR1H2 P55055 1/20 0.43
BAX Q07812 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
SCHEMBL12514597 0.90 ALDH1A1 (0.61) FFAR1LTA4HALDH1A1HPGDALOX15
SCHEMBL2201304 0.87 FFAR1 (0.62) FFAR1LTA4HTSHRPLAAT3PLAAT5
SCHEMBL19322272 0.87 FFAR1 (0.62) FFAR1LTA4HTSHRPLAAT3PLAAT5
SCHEMBL19322285 0.85 FFAR1 (0.60) FFAR1LTA4HTSHRPLAAT3PLAAT5
SCHEMBL19322269 0.85 FFAR1 (0.60) FFAR1LTA4HTSHRPLAAT3PLAAT5
SCHEMBL19322273 0.85 FFAR1 (0.60) FFAR1LTA4HTSHRPLAAT3PLAAT5
SCHEMBL8420664 0.85 KCNA3 (0.59) FFAR1LTA4HPPARGEPHX2
SCHEMBL12040543 0.83 FFAR1 (0.58) FFAR1LTA4HALOX15TSHRPLAAT3
SCHEMBL416807 0.83 FDFT1 (0.51) FFAR1FDFT1
SCHEMBL19322270 0.83 LTA4H (0.67) FFAR1LTA4HTSHRPLAAT3PLAAT5

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
EP-0485026-A2 Antimanic phenoxymethylene bisphosphonate derivatives MERCK SHARP & DOHME LTD. (GB) 1992-05-13 EP disclosed