SCHEMBL13460943

SCHEMBL13460943

O=Cc1cccc(-c2cccc(CNC(=O)c3ccc(C(F)(F)F)cc3F)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 5/20 0.49
▸ PPARA Q07869 4/20 0.49
▸ PPARG P37231 2/20 0.49
▸ MLYCD O95822 1/20 0.48
▸ LMNA P02545 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ CHRM3 P20309 3/20 0.46
▸ SORT1 Q99523 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ PLA2G1B P04054 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ ATG4B Q9Y4P1 1/20 0.45
▸ MAPK14 Q16539 1/20 0.44
▸ KCNQ3 O43525 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
SCHEMBL13460888 0.85 PPARD (0.52) PPARDPPARAPPARGLMNAHPGD
SCHEMBL3417343 0.85 PPARD (0.53) PPARDPPARAPPARGMLYCDLMNA
SCHEMBL3419024 0.84 PPARD (0.64) PPARDPPARAPPARGMLYCDLMNA
SCHEMBL13460768 0.83 PPARD (0.61) PPARDPPARAPPARG
SCHEMBL13460939 0.81 PPARD (0.66) PPARDPPARAPPARG
SCHEMBL13460846 0.80 PPARD (0.58) PPARDPPARAPPARG
SCHEMBL13460798 0.80 PPARD (0.71) PPARDPPARAPPARG
SCHEMBL13460799 0.79 PPARD (0.53) PPARDPPARAPPARGLMNA
SCHEMBL13460759 0.79 PPARD (0.45) PPARDPPARAPPARG
SCHEMBL13460899 0.78 PSEN1 (0.62) PPARDPPARAPPARG

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-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 — — US disclosed
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