SCHEMBL10754154

SCHEMBL10754154

CC1(C)CCc2cc3c(cc2O1)OCO3

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
KMT2A Q03164 3/20 0.39
CHRNA7 P36544 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
GLA P06280 2/20 0.38
CYP2D6 P10635 2/20 0.38
HPGD P15428 2/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MEN1 O00255 2/20 0.38
PKM P14618 2/20 0.37
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
PDE10A Q9Y233 1/20 0.36
PKLR P30613 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
SCHEMBL5308527 0.86 NPC1 (0.43) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL21363752 0.81 CYP3A4 (0.37) MAPTKMT2ACHRNA7KDM4EALDH1A1
SCHEMBL577986 0.73 BCHE (0.49) MAPTNPC1RAB9AKDM4EPDE10A
SCHEMBL28157945 0.73 PDE10A (0.40) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL23423286 0.71 PKM (0.41) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL2484407 0.71 BCHE (0.45) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL5986967 0.71 PKM (0.41) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL10820252 0.71 CTSB (0.43) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL6849624 0.70 PKM (0.49) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL7606467 0.70 PKM (0.40) MAPTNPC1RAB9AKMT2AKDM4E

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-4656189-A INSECTICIDES CORNELL RESEARCH FOUNDATION, INC. (US) 1987-04-07 US disclosed