SCHEMBL7512909

SCHEMBL7512909

CC(C)(C)OC(=O)C1CC(C2CCNCC2)CCN1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.34
NR1H2 P55055 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31

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
SCHEMBL28664063 0.82 GPR119 (0.30)
SCHEMBL7379626 0.81 MAPK1 (0.36) CHRM2CHRM1CHRM3
SCHEMBL22152561 0.81 MAPK1 (0.36) CHRM2CHRM1CHRM3
SCHEMBL7359958 0.81 MAPK1 (0.36) CHRM2CHRM1CHRM3
SCHEMBL28650431 0.81 GRIN2D (0.36) NR1H2
SCHEMBL5651571 0.80 GABRP (0.32) CHRM2CHRM1CHRM3
SCHEMBL5261052 0.79 CHRM2 (0.40) CHRM2CHRM1CHRM3
SCHEMBL27682940 0.78 NR1H2 (0.41) NR1H2
SCHEMBL28044033 0.78 CHRM2 (0.33) CHRM2CHRM1CHRM3
SCHEMBL29172731 0.76 ARG1 (0.35) NR1H2

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-1998046599-A1 NOVEL CARBOXAMIDES AS PLATELET AGGREGATION INHIBITORS J. URIACH & CIA. S.A. (ES) 1998-10-22 WO disclosed