SCHEMBL27975917

SCHEMBL27975917

COc1ccc(-c2nc(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)n2Cc2ccc(-c3ccccc3)c(C(=O)O)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.52
▸ PPARG P37231 5/20 0.49
▸ GAA P10253 4/20 0.48
▸ MGAM O43451 3/20 0.48
▸ SI P14410 3/20 0.48
▸ MGAM2 Q2M2H8 3/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ HTT P42858 3/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ CNR2 P34972 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CCR2 P41597 1/20 0.46
▸ MAPT P10636 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ DRD2 P14416 1/20 0.44
▸ TBXA2R P21731 1/20 0.44

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
SCHEMBL27975918 1.00 TP53 (0.52) TP53PPARGGAAMGAMSI
SCHEMBL27975920 0.96 TP53 (0.48) TP53PPARGGAAMGAMSI
SCHEMBL28096950 0.95 PPARG (0.51) TP53PPARGGAAMGAMSI
SCHEMBL28096774 0.87 HTT (0.45) TP53PPARGGAAMGAMSI
SCHEMBL27976295 0.83 GAA (0.46) PPARGGAAMGAMSIMGAM2
Trifluoroacetic Acid SCHEMBL8798382 0.74 ALDH1A1 (0.54) TP53GAAMGAMSIMGAM2
SCHEMBL8798390 0.74 ALDH1A1 (0.54) TP53GAAMGAMSIMGAM2
SCHEMBL8393562 0.74 SMN1; SMN2 (0.73) TP53PPARGGAASMN1; SMN2HTT
SCHEMBL8823088 0.74 HTT (0.48) TP53PPARGGAASMN1; SMN2HTT
SCHEMBL17955990 0.74 RXRA (0.48) GAAMGAMSIMGAM2KDM4E

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
CN-103992276-A 4'-{[(2,4,5-trisubstituted phenyl)-1H-imidazole-1-yl]methyl}biphenyl-2-formic acid derivatives JILIN INST OF PHARMACEUTICAL RES 2014-08-20 — — CN disclosed
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