SCHEMBL7937593

SCHEMBL7937593

CC(C)(C)OC(=O)[C@@]12CC[C@@H](C[C@@H](O)C1)N2

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
BTK Q06187 1/20 0.30

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
SCHEMBL7937595 1.00 CHRM2 (0.36) CHRM2CHRM1CHRM3BTK
SCHEMBL15240480 0.84 CHRM2 (0.32) CHRM2CHRM1CHRM3
SCHEMBL14964937 0.83
SCHEMBL20586469 0.82 DDB1 (0.33) CHRM2CHRM1CHRM3BTK
SCHEMBL7909364 0.81
SCHEMBL17317533 0.80 NR1H2 (0.30)
SCHEMBL6216318 0.75
SCHEMBL31172959 0.75
SCHEMBL31008074 0.73
SCHEMBL14736393 0.73 CHRM2 (0.34) CHRM2CHRM1CHRM3

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-6255319-B1 ANTISEROTONIN AGENT SANOFI-SYNTHELABO (FR) 2001-07-03 US disclosed