SCHEMBL7064465

SCHEMBL7064465

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

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.38
KMT2A Q03164 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MDM2 Q00987 1/20 0.36
ALDH1A1 P00352 4/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA9 Q16790 2/20 0.36
CA2 P00918 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
PSMD10 O75832 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.34
SIRT5 Q9NXA8 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL7973217 0.93 PSMD10 (0.38) STAT3KMT2ANPC1RAB9AMDM2
SCHEMBL7973483 0.91 PSMD10 (0.37) STAT3KMT2ANPC1RAB9AMDM2
SCHEMBL7066495 0.88 RAB9A (0.39) KMT2ARAB9AALDH1A1CA12CA1
SCHEMBL7066596 0.87 STAT3 (0.42) STAT3KMT2AALDH1A1LMNACYP3A4
SCHEMBL7064469 0.87 KMT2A (0.42) STAT3KMT2AALDH1A1LMNACA12
SCHEMBL7065786 0.86 STAT3 (0.37) STAT3KMT2AALDH1A1LMNAGAA
SCHEMBL7067264 0.82 PLA2G2C (0.39) STAT3KMT2AALDH1A1LMNACA12
SCHEMBL7060903 0.81 HTT (0.39) STAT3KMT2AALDH1A1LMNACYP1A2
SCHEMBL7971396 0.81 RAB9A (0.37) KMT2ARAB9AALDH1A1GAA
SCHEMBL7060908 0.81 PLA2G2C (0.44) STAT3NPC1RAB9AALDH1A1LMNA

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