SCHEMBL7064409

SCHEMBL7064409

CC(OC(=O)C1CCN1C(C)c1ccc(Cl)cc1Cl)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.44
CNR2 P34972 12/20 0.44
CACNA1G O43497 1/20 0.41
CACNA2D1 P54289 3/20 0.40
CACNA1B Q00975 3/20 0.40
CACNB1 Q02641 3/20 0.40
CACNA1C Q13936 2/20 0.40
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39
P2RX7 Q99572 1/20 0.39
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38

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
SCHEMBL7066253 0.87 ALDH1A1 (0.39) CNR1CNR2P2RX7
SCHEMBL7067276 0.85 OPRM1 (0.43) OPRM1OPRD1OPRK1OPRL1
SCHEMBL7068411 0.85 CNR1 (0.41) CNR1CNR2CACNA1GCACNA2D1CACNA1B
SCHEMBL7066175 0.83 ALDH1A1 (0.47) CNR1CNR2P2RX7
SCHEMBL6235377 0.83 ALDH1A1 (0.47) CNR1CNR2P2RX7
SCHEMBL6233904 0.83 ALDH1A1 (0.47) CNR1CNR2P2RX7
SCHEMBL7064427 0.83 HCAR2 (0.42) OPRM1OPRD1OPRK1OPRL1
SCHEMBL7064598 0.82 FKBP1A (0.43) CNR1CNR2P2RX7
SCHEMBL7107139 0.81 NOTUM (0.43) CNR1CNR2P2RX7
SCHEMBL7061492 0.81 NOTUM (0.43) CNR1CNR2P2RX7

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