SCHEMBL879330

SCHEMBL879330

CC(=O)OC1CNCC[C@@H]1OC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 5/20 0.41
CHRM1 P11229 3/20 0.41
CHRM4 P08173 2/20 0.41
CHRM3 P20309 2/20 0.41
MEN1 O00255 1/20 0.40
CYP2D6 P10635 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC6A1 P30531 2/20 0.35
GABRA5 P31644 2/20 0.35
GABRB2 P47870 2/20 0.35
SLC6A12 P48065 2/20 0.35
SLC6A11 P48066 2/20 0.35
SLC6A13 Q9NSD5 2/20 0.35
GABRA1 P14867 1/20 0.35
GABRR1 P24046 1/20 0.35
GABRA4 P48169 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
SCHEMBL10130053 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL18388007 0.88 SLC6A1 (0.42) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL18498636 0.84 CHRM2 (0.42) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL7226282 0.84 CHRM2 (0.39) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL7234667 0.84 CHRM2 (0.39) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL23386481 0.84 CHRM2 (0.39) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL28807483 0.84 CHRM2 (0.39) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL7234198 0.84 CHRM2 (0.39) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL7225571 0.84 CHRM2 (0.39) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL7225569 0.84 CHRM2 (0.39) CHRM2CHRM1CHRM4CHRM3MEN1

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
EP-1682537-B1 MODULATORS OF CELLULAR ADHESION SARCODE BIOSCIENCE INC (US) 2012-03-28 EP disclosed