SCHEMBL8935685

SCHEMBL8935685

CCC(Oc1c(Cl)cccc1Cl)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.49
KMT2A Q03164 1/20 0.47
PPARA Q07869 15/20 0.46
PPARG P37231 13/20 0.46
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
AKR1B1 P15121 1/20 0.39

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
SCHEMBL8935688 1.00 SMN1; SMN2 (0.49) SMN1; SMN2KMT2APPARAPPARGTAS1R3
SCHEMBL4370192 0.82 SMN1; SMN2 (0.45) SMN1; SMN2KMT2APPARAPPARGTAS1R3
SCHEMBL8935901 0.81 PPARA (0.51) SMN1; SMN2KMT2APPARAPPARG
SCHEMBL5063037 0.81 PPARA (0.51) SMN1; SMN2KMT2APPARAPPARG
SCHEMBL28829280 0.81 SMN1; SMN2 (0.48) SMN1; SMN2PPARAPPARG
SCHEMBL31698014 0.81 SMN1; SMN2 (0.48) SMN1; SMN2PPARAPPARG
SCHEMBL8935675 0.81 SMN1; SMN2 (0.58) SMN1; SMN2KMT2APPARAPPARG
SCHEMBL8935678 0.81 SMN1; SMN2 (0.58) SMN1; SMN2KMT2APPARAPPARG
SCHEMBL8935787 0.79 SMN1; SMN2 (0.49) SMN1; SMN2PPARAPPARG
SCHEMBL8935912 0.79 SMN1; SMN2 (0.49) SMN1; SMN2PPARAPPARG

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-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US disclosed