SCHEMBL7066526

SCHEMBL7066526

Cc1ccc(C(C)N2CCC2C(=O)OC(C)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.41
OPRD1 P41143 2/20 0.41
OPRK1 P41145 2/20 0.41
OPRL1 P41146 2/20 0.41
FKBP1A P62942 1/20 0.41
GRIN2B Q13224 1/20 0.38
HCAR2 Q8TDS4 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HTR1E P28566 1/20 0.38
S1PR3 Q99500 1/20 0.38
CHRM2 P08172 3/20 0.37
CHRM4 P08173 3/20 0.37
CHRM5 P08912 3/20 0.37
CHRM1 P11229 3/20 0.37
CHRM3 P20309 3/20 0.37
CCR5 P51681 1/20 0.37
CACNA2D1 P54289 1/20 0.37
CACNA1B Q00975 1/20 0.37
CACNB1 Q02641 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
SCHEMBL7064427 0.94 HCAR2 (0.42) OPRM1OPRD1OPRK1OPRL1GRIN2B
SCHEMBL7067276 0.89 OPRM1 (0.43) OPRM1OPRD1OPRK1OPRL1FKBP1A
SCHEMBL7065732 0.88 OPRM1 (0.46) OPRM1OPRD1OPRK1OPRL1CACNA2D1
SCHEMBL7062139 0.86 CHRNA1 (0.43) SLC6A4SLC6A3CHRM2CHRM1ALDH1A1
SCHEMBL7066810 0.84 CHRM2 (0.41) OPRM1OPRD1OPRK1OPRL1CHRM2
SCHEMBL7067151 0.84 GAA (0.40) OPRM1OPRD1OPRK1OPRL1SLC6A3
SCHEMBL6229831 0.82 TSHR (0.45) SLC6A4SLC6A3ALDH1A1
SCHEMBL7062874 0.82 TSHR (0.45) SLC6A4SLC6A3ALDH1A1
SCHEMBL6232109 0.82 TSHR (0.45) SLC6A4SLC6A3ALDH1A1
SCHEMBL7066507 0.81 FKBP1A (0.47) FKBP1A

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