SCHEMBL7062152

SCHEMBL7062152

CC(c1ccccc1)N1CCC1C(=O)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
CHRM2 P08172 3/20 0.43
CHRM4 P08173 3/20 0.43
CHRM5 P08912 3/20 0.43
CHRM1 P11229 3/20 0.43
CHRM3 P20309 3/20 0.43
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MGLL Q99685 1/20 0.42
CYP2D6 P10635 1/20 0.40
SLC6A3 Q01959 1/20 0.40
OPRK1 P41145 4/20 0.40
OPRM1 P35372 2/20 0.40
OPRD1 P41143 1/20 0.40
OPRL1 P41146 1/20 0.40
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KCNH2 Q12809 3/20 0.39
CHRNA7 P36544 1/20 0.39
HTR3A P46098 1/20 0.39

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
SCHEMBL7067151 0.92 GAA (0.40) GAACHRM2CHRM4CHRM5CHRM1
SCHEMBL7068101 0.91 SLC6A2 (0.46) GAAALDH1A1SMN1; SMN2MGLLSLC6A3
SCHEMBL7066363 0.91 OPRM1 (0.44) GAACHRM2ALDH1A1SMN1; SMN2OPRK1
SCHEMBL7060888 0.86 TSHR (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL2773433 0.86 TSHR (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL2772366 0.86 TSHR (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL2772125 0.86 TSHR (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7064464 0.86 TSHR (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7066810 0.84 CHRM2 (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7064427 0.83 HCAR2 (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3

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