SCHEMBL7064430

SCHEMBL7064430

CCOC(=O)C(CCOS(=O)(=O)c1ccccc1)OS(=O)(=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
CYP2C19 P33261 1/20 0.39
PIN1 Q13526 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
APP P05067 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
TSHR P16473 1/20 0.39
POLB P06746 1/20 0.38
HSD11B1 P28845 1/20 0.38
CA12 O43570 1/20 0.37

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
SCHEMBL7972830 0.92 TDP1 (0.46) TDP1ATMSMN1; SMN2NPC1RAB9A
SCHEMBL7969622 0.91 TDP1 (0.42) TDP1ATMSMN1; SMN2NPC1RAB9A
SCHEMBL7064469 0.89 KMT2A (0.42) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL7067159 0.88 TSHR (0.41) TDP1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL7067274 0.88 KMT2A (0.41) ATMSMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL7066679 0.86 TSHR (0.44) SMN1; SMN2NPC1RAB9AALDH1A1HSD17B10
SCHEMBL7068104 0.85 ALDH1A1 (0.40) TDP1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL7066495 0.85 RAB9A (0.39) RAB9AALDH1A1KMT2AMEN1CYP2C19
SCHEMBL7066211 0.85 CCR5 (0.37) ALDH1A1MAPTAPP
SCHEMBL7067287 0.84 CA1 (0.40) TDP1SMN1; SMN2NPC1RAB9AALDH1A1

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