SCHEMBL10693064

SCHEMBL10693064

CCC(C)OC(=O)CC(Cc1ccccc1)c1ccc(Oc2ccc(-c3ccc(Cl)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.46
PPARA Q07869 8/20 0.46
NPY5R Q15761 1/20 0.44
MAPT P10636 1/20 0.44
ACACB O00763 3/20 0.43
ACACA Q13085 2/20 0.43
FNTA P49354 5/20 0.42
FNTB P49356 5/20 0.42
FDFT1 P37268 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
SCHEMBL10693486 0.83 FNTA (0.58) PPARGPPARAFNTAFNTB
SCHEMBL10693075 0.73 MAPT (0.41) PPARGPPARAMAPTACACBACACA
SCHEMBL10694757 0.68 MAOB (0.49) MAPT
SCHEMBL10694760 0.68 MAOB (0.49) MAPT
SCHEMBL2356411 0.67 EPHX1 (0.65) PPARGPPARANPY5RFNTAFNTB
SCHEMBL10809925 0.67 FNTA (0.47) PPARGPPARAFNTAFNTB
SCHEMBL11163216 0.66 TSHR (0.51) PPARGPPARA
SCHEMBL31555289 0.66 F2 (0.56) MAPT
SCHEMBL11507662 0.66 KMT2A (0.42) PPARGPPARAMAPT
SCHEMBL27617788 0.66 MTNR1A (0.58)

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-4748185-A RODENTICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-31 US disclosed