SCHEMBL7060908

SCHEMBL7060908

CCCCCCCCOC(=O)C(CCOS(=O)(=O)c1ccc(C)cc1)OS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 1/20 0.44
ALDH1A1 P00352 4/20 0.37
TSHR P16473 3/20 0.37
LMNA P02545 2/20 0.37
MCHR1 Q99705 1/20 0.37
STS P08842 5/20 0.36
ALB P02768 1/20 0.36
CYP2C9 P11712 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
S1PR3 Q99500 1/20 0.36
STAT3 P40763 1/20 0.36
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL7067264 0.95 PLA2G2C (0.39) PLA2G2CALDH1A1TSHRLMNASTS
SCHEMBL7972874 0.94 PLA2G2C (0.43) PLA2G2CALDH1A1TSHRLMNAMCHR1
SCHEMBL7960303 0.94 PLA2G2C (0.43) PLA2G2CALDH1A1TSHRLMNAMCHR1
SCHEMBL7973218 0.91 PLA2G2C (0.40) PLA2G2CALDH1A1TSHRLMNASTS
SCHEMBL7066679 0.89 TSHR (0.44) ALDH1A1TSHRLMNATP53CYP3A4
SCHEMBL7971365 0.89 KMT2A (0.40) PLA2G2CALDH1A1TSHRLMNASTS
SCHEMBL7064469 0.88 KMT2A (0.42) ALDH1A1TSHRLMNASTAT3MAPT
SCHEMBL7067159 0.84 TSHR (0.41) ALDH1A1TSHRLMNATDP1TP53
SCHEMBL7976224 0.84 KMT2A (0.42) PLA2G2CALDH1A1TSHRLMNASTAT3
SCHEMBL7976145 0.84 TSHR (0.43) ALDH1A1TSHRLMNATP53CYP3A4

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