SCHEMBL8870748

SCHEMBL8870748

CO[C@H]1CC[C@@H](C(=O)O)N1C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.45
CHRM1 P11229 1/20 0.45
CHRM3 P20309 1/20 0.45
HSD17B10 Q99714 1/20 0.39
PREP P48147 4/20 0.38
EPHX1 P07099 1/20 0.36
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
GPR119 Q8TDV5 1/20 0.34
HSD11B1 P28845 1/20 0.33
RECQL P46063 1/20 0.33
USP2 O75604 1/20 0.33
NR1H2 P55055 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
SCHEMBL5549677 1.00 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL5549676 1.00 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL15635071 0.87 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL14724992 0.87 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL12295954 0.87 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL14714350 0.87 CHRM2 (0.45) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL19838965 0.86 CHRM2 (0.53) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL5832813 0.86 CHRM2 (0.44) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL8205840 0.86 CHRM2 (0.44) CHRM2CHRM1CHRM3HSD17B10PREP
SCHEMBL12328185 0.86 CHRM2 (0.44) CHRM2CHRM1CHRM3HSD17B10PREP

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-5610144-A CHOLECYSTOKININ OR GASTRIN ANTAGONISTS; NERVOUS SYSTEM AND GASTROINTESTINAL DISORDERS RHONE-POULENC RORER S.A. (FR) 1997-03-11 US disclosed