SCHEMBL7066355

SCHEMBL7066355

COc1ccc(C(C)N2CCC2C(=O)OCc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 5/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
ACHE P22303 1/20 0.47
FABP7 O15540 1/20 0.46
FABP5 Q01469 1/20 0.46
MMP1 P03956 1/20 0.45
MMP2 P08253 1/20 0.45
MMP3 P08254 1/20 0.45
MMP7 P09237 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
ATM Q13315 1/20 0.43
CHRM5 P08912 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
ALDH1A1 P00352 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
MAPKAPK2 P49137 1/20 0.42
PREP P48147 1/20 0.42

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
SCHEMBL7064400 0.91 FKBP1A (0.50) FKBP1AALDH1A1PREP
SCHEMBL7068394 0.89 FKBP1A (0.51) FKBP1ACHRM5CHRM1CHRM3
SCHEMBL7066507 0.89 FKBP1A (0.47) FKBP1ACA1CA2PREP
SCHEMBL7062463 0.88 CCR1 (0.46) FKBP1A
SCHEMBL8077137 0.86 CHRM2 (0.42) ACHEALDH1A1
SCHEMBL7065723 0.85 ALDH1A1 (0.46) ALDH1A1
SCHEMBL7066363 0.84 OPRM1 (0.44) ALDH1A1
SCHEMBL6233365 0.82 PKM (0.44) CHRM1CHRM3ALDH1A1
SCHEMBL7068098 0.82 PKM (0.44) CHRM1CHRM3ALDH1A1
SCHEMBL6231716 0.82 PKM (0.44) CHRM1CHRM3ALDH1A1

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