SCHEMBL7973159

SCHEMBL7973159

O=C(Oc1ccccc1)C(CCCOS(=O)(=O)c1ccccc1)OS(=O)(=O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
TDP1 Q9NUW8 2/20 0.37
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PTGES O14684 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
ELANE P08246 1/20 0.31
ENPP3 O14638 1/20 0.31
CA2 P00918 1/20 0.31
ENPP1 P22413 1/20 0.31
ENPP2 Q13822 1/20 0.31
CA9 Q16790 1/20 0.31
CASP3 P42574 1/20 0.31
CTRC Q99895 1/20 0.31
PARL Q9H300 1/20 0.31

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
SCHEMBL7959874 0.96 MAPT (0.39) MAPTTDP1ATML3MBTL1PTGES
SCHEMBL7065836 0.92 MAPT (0.41) MAPTTDP1ATML3MBTL1PTGES
SCHEMBL7976225 0.92 TDP1 (0.39) TDP1PTGESSMN1; SMN2
SCHEMBL7976100 0.88 CYP24A1 (0.37) TDP1PTGESSMN1; SMN2
SCHEMBL7972978 0.86 KMT2A (0.40) TDP1ATMSMN1; SMN2CA2CA9
SCHEMBL7972830 0.85 TDP1 (0.46) MAPTTDP1ATML3MBTL1SMN1; SMN2
SCHEMBL7060903 0.84 HTT (0.39) PTGESSMN1; SMN2
SCHEMBL7969990 0.84 ALDH1A1 (0.38) TDP1L3MBTL1SMN1; SMN2ELANECA2
SCHEMBL7971396 0.84 RAB9A (0.37) TDP1
SCHEMBL7973451 0.82 CA1 (0.38) TDP1L3MBTL1PTGESSMN1; SMN2CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6172234-B1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-01-09 US disclosed
EP-0976729-A1 Optically active cyclic amino acid ester derivatives and processes for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP disclosed