SCHEMBL9716865

SCHEMBL9716865

CCCCCCCOc1cccc(C=CC(=O)NC(Cc2ccccc2)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 2/20 0.54
▸ ALDH1A1 P00352 3/20 0.53
▸ MAPT P10636 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ CYSLTR2 Q9NS75 4/20 0.49
▸ NOS2 P35228 1/20 0.48
▸ PPARG P37231 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ PKM P14618 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ CYSLTR1 Q9Y271 3/20 0.45
▸ CNR1 P21554 1/20 0.45
▸ BCHE P06276 1/20 0.44
▸ EGFR P00533 1/20 0.44
▸ GPR88 Q9GZN0 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
SCHEMBL9716861 1.00 CNR2 (0.54) CNR2ALDH1A1MAPTHTTNPSR1
SCHEMBL9716922 0.89 PPARG (0.56) CNR2NOS2PPARGHDAC8BCHE
SCHEMBL9716917 0.89 PPARG (0.56) CNR2NOS2PPARGHDAC8BCHE
SCHEMBL9716988 0.89 PPARG (0.56) CNR2NOS2PPARGHDAC8BCHE
SCHEMBL9716990 0.89 PPARG (0.56) CNR2NOS2PPARGHDAC8BCHE
SCHEMBL9717052 0.82 CNR2 (0.52) CNR2ALDH1A1MAPTHTTNPSR1
SCHEMBL9717048 0.82 CNR2 (0.52) CNR2ALDH1A1MAPTHTTNPSR1
SCHEMBL9717013 0.82 CNR2 (0.52) CNR2ALDH1A1MAPTHTTNPSR1
SCHEMBL9717046 0.82 CNR2 (0.52) CNR2ALDH1A1MAPTHTTNPSR1
SCHEMBL9716927 0.82 CNR2 (0.52) CNR2ALDH1A1MAPTHTTNPSR1

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
WO-1992009561-A1 NEW AMIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-06-11 — — WO disclosed
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