SCHEMBL10360378

SCHEMBL10360378

CC(Oc1ncn(-c2ccc(C(F)(F)F)cc2)n1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 3/20 0.44
PPARA Q07869 3/20 0.44
MAPT P10636 1/20 0.40
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CASR P41180 3/20 0.38
PTGDR2 Q9Y5Y4 4/20 0.36
ABCB11 O95342 1/20 0.36
MGLL Q99685 1/20 0.35
PPARG P37231 1/20 0.35
ATM Q13315 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
SCHEMBL10361318 0.89 MAPT (0.42) PPARDPPARAMAPTKDM4EALDH1A1
SCHEMBL10361126 0.87 BCHE (0.36) PPARDPPARAMAPTKDM4EALDH1A1
SCHEMBL10360294 0.87 SCN9A (0.36) MAPTKDM4EALDH1A1CASR
SCHEMBL10360302 0.86 NOTUM (0.43) MAPTALDH1A1PTGDR2
SCHEMBL10361080 0.86 POLB (0.43) PPARDPPARAMAPTALDH1A1
SCHEMBL10360667 0.85 PPARD (0.39) PPARDPPARAMAPTKDM4EALDH1A1
SCHEMBL10360399 0.84 MAPT (0.44) MAPTKDM4EALDH1A1
SCHEMBL10361312 0.84 MAPT (0.56) MAPTKDM4EALDH1A1
SCHEMBL10360696 0.83 MAPT (0.43) MAPTKDM4EALDH1A1PTGDR2
SCHEMBL10360706 0.83 MAPT (0.43) MAPTKDM4EALDH1A1

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-4931083-A Plant growth regulating triazoles ELI LILLY AND COMPANY (US) 1990-06-05 US disclosed