SCHEMBL7065781

SCHEMBL7065781

Cc1ccc(S(=O)(=O)OCCC(OS(=O)(=O)c2ccc(C)cc2)C(=O)OCc2ccccc2C)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ADAM17 P78536 2/20 0.38
F13A1 P00488 1/20 0.36
TGM2 P21980 1/20 0.36
TGM1 P22735 1/20 0.36
LMNA P02545 1/20 0.35
STAT3 P40763 1/20 0.34
MMP1 P03956 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
SLC1A5 Q15758 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL7066211 0.93 CCR5 (0.37) ALDH1A1ADAM17F13A1TGM2TGM1
SCHEMBL7064562 0.86 LMNA (0.49) ALDH1A1LMNACA1
SCHEMBL7064469 0.83 KMT2A (0.42) ALDH1A1MEN1KMT2ALMNASTAT3
SCHEMBL7065725 0.81 ALDH1A1 (0.42) ALDH1A1MEN1KMT2ALMNASTAT3
SCHEMBL7066596 0.81 STAT3 (0.42) ALDH1A1MEN1KMT2ALMNASTAT3
SCHEMBL7060903 0.81 HTT (0.39) ALDH1A1KMT2ALMNASTAT3
SCHEMBL7064391 0.80 MAOB (0.36) ALDH1A1F13A1TGM2TGM1LMNA
SCHEMBL7060915 0.80 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ALMNAMMP1
SCHEMBL7975992 0.80 LMNA (0.47) LMNACA1
SCHEMBL7067264 0.79 PLA2G2C (0.39) ALDH1A1MEN1KMT2ALMNASTAT3

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