SCHEMBL7066798

SCHEMBL7066798

CCCCCCCCOC(=O)C1CCN1C(C)c1ccc(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CNR1 P21554 2/20 0.38
MAPT P10636 2/20 0.38
CNR2 P34972 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
FKBP1A P62942 1/20 0.37
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL7066644 0.96 ALDH1A1 (0.43) ALDH1A1TDP1L3MBTL1CNR1MAPT
SCHEMBL7066156 0.87 MAPT (0.47) ALDH1A1MAPTTSHRMAPK1RECQL
SCHEMBL7066432 0.85 FKBP1A (0.43) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL7064487 0.83 FKBP1A (0.44) L3MBTL1CNR1CNR2CHRM2CHRM4
SCHEMBL6233904 0.81 ALDH1A1 (0.47) ALDH1A1CNR1CNR2TSHR
SCHEMBL7066175 0.81 ALDH1A1 (0.47) ALDH1A1CNR1CNR2TSHR
SCHEMBL6235377 0.81 ALDH1A1 (0.47) ALDH1A1CNR1CNR2TSHR
SCHEMBL7067156 0.81 FKBP1A (0.44) ALDH1A1L3MBTL1FKBP1ATSHR
SCHEMBL7064598 0.80 FKBP1A (0.43) L3MBTL1CNR1CNR2FKBP1A
SCHEMBL7060882 0.78 CHRM2 (0.47) ALDH1A1CHRM2CHRM4CHRM5CHRM1

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