SCHEMBL7067151

SCHEMBL7067151

Cc1ccc(C(C)N2CCC2C(=O)Oc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
OPRL1 P41146 1/20 0.40
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CHRM2 P08172 3/20 0.38
CHRM4 P08173 3/20 0.38
CHRM5 P08912 3/20 0.38
CHRM1 P11229 3/20 0.38
CHRM3 P20309 3/20 0.38
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SLC6A3 Q01959 1/20 0.37

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
SCHEMBL7062152 0.92 GAA (0.43) GAAOPRM1OPRD1OPRK1OPRL1
SCHEMBL7068101 0.89 SLC6A2 (0.46) GAAOPRM1OPRD1OPRK1OPRL1
SCHEMBL7066363 0.89 OPRM1 (0.44) GAAOPRM1OPRD1OPRK1OPRL1
SCHEMBL7066526 0.84 OPRM1 (0.41) OPRM1OPRD1OPRK1OPRL1ALDH1A1
SCHEMBL6232109 0.83 TSHR (0.45) ALDH1A1SLC6A3
SCHEMBL7062874 0.83 TSHR (0.45) ALDH1A1SLC6A3
SCHEMBL6229831 0.83 TSHR (0.45) ALDH1A1SLC6A3
SCHEMBL7066507 0.82 FKBP1A (0.47) SMN1; SMN2
SCHEMBL7062139 0.82 CHRNA1 (0.43) ALDH1A1CHRM2CHRM1SLC6A3
SCHEMBL7065814 0.81 TSHR (0.41) OPRM1OPRD1OPRK1OPRL1ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0827954-B1 Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL CO (JP) 2003-06-04 EP disclosed
US-6114543-A Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-09-05 US disclosed
US-5880291-A Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-03-09 US disclosed
EP-0827954-A1 Process for producing optically active azetidine-2-carboxylic acid SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-03-11 EP disclosed