SCHEMBL9762485

SCHEMBL9762485

O=C1CCON1Cc1cncnc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.38
CHRM4 P08173 2/20 0.38
CHRM5 P08912 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
CYP1B1 Q16678 4/20 0.36
GRM2 Q14416 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRA5 P31644 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33

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
SCHEMBL9762141 0.79 KDM4E (0.39) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9760860 0.77 LOXL2 (0.39) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL44669 0.75 L3MBTL1 (0.45) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7847449 0.75 L3MBTL1 (0.45) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9761755 0.75 CHRM2 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9762539 0.73 CHRM2 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL18763113 0.72 ALDH1A1 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9762330 0.71 CHRM5 (0.43) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9762460 0.71 RIPK3 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9760799 0.69 BRD4 (0.37) CYP1B1GRM2GABRA1GABRA5

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-5066665-A Cognition activators; alzheimer*s disease WARNER-LAMBERT CO. (US) 1991-11-19 US disclosed