SCHEMBL20199371

SCHEMBL20199371

CN(CCO)CCCC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
CHRM2 P08172 2/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
GGPS1 O95749 1/20 0.32
FDPS P14324 1/20 0.32
AGTR1 P30556 1/20 0.32
OPRM1 P35372 1/20 0.32
PDE3A Q14432 1/20 0.32

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
SCHEMBL17225210 0.87 CHRM2 (0.39) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL12890963 0.85 MAPT (0.41) MAPTGGPS1FDPSAGTR1OPRM1
SCHEMBL13649903 0.82 CHRM2 (0.36) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL26455608 0.79 CHRM2 (0.43) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL26455602 0.79 CHRM2 (0.43) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL7849316 0.79 MAPT (0.50) MAPTCHRM2CHRM4CHRM5CHRM1
SCHEMBL25055188 0.78 CA12 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8949457 0.78 MAPT (0.33) MAPT
SCHEMBL15182739 0.78 ALDH1A1 (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL19504856 0.78 CHRM2 (0.50) CHRM2CHRM4CHRM5CHRM1CHRM3

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-20180149977-A1 COMPOSITION FOR COATING RESIST PATTERN NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-05-31 US disclosed