SCHEMBL7060903

SCHEMBL7060903

Cc1ccc(S(=O)(=O)OCCC(OS(=O)(=O)c2ccc(C)cc2)C(=O)Oc2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.39
STAT3 P40763 1/20 0.39
PTGES O14684 1/20 0.38
KMT2A Q03164 1/20 0.38
GAA P10253 1/20 0.38
LMNA P02545 2/20 0.37
DHODH Q02127 1/20 0.37
RECQL P46063 1/20 0.36
CYP2C9 P11712 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
MMP13 P45452 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
SCHEMBL7976225 0.93 TDP1 (0.39) HTTSMN1; SMN2ALDH1A1STAT3PTGES
SCHEMBL7976100 0.92 CYP24A1 (0.37) HTTSMN1; SMN2ALDH1A1STAT3PTGES
SCHEMBL7065836 0.91 MAPT (0.41) SMN1; SMN2PTGES
SCHEMBL7064562 0.85 LMNA (0.49) ALDH1A1LMNA
SCHEMBL7973159 0.84 MAPT (0.39) SMN1; SMN2PTGES
SCHEMBL7065725 0.84 ALDH1A1 (0.42) ALDH1A1STAT3KMT2AGAALMNA
SCHEMBL7064469 0.84 KMT2A (0.42) SMN1; SMN2ALDH1A1STAT3KMT2AGAA
SCHEMBL7066596 0.84 STAT3 (0.42) HTTSMN1; SMN2ALDH1A1STAT3KMT2A
SCHEMBL7959874 0.83 MAPT (0.39) SMN1; SMN2PTGES
SCHEMBL7065786 0.83 STAT3 (0.37) ALDH1A1STAT3KMT2AGAALMNA

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