SCHEMBL9845555

SCHEMBL9845555

O=C(O)c1cc(S(=O)(=O)O)c2ccccc2c1C(=O)O.[NaH].[NaH]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 13/20 0.50
HSD17B10 Q99714 2/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2D6 P10635 1/20 0.49
MPL P40238 3/20 0.48
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP1A2 P05177 1/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
RCE1 Q9Y256 1/20 0.43
SUMO2 P61956 1/20 0.42
SUMO1 P63165 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP2 Q9HC62 1/20 0.42
SENP1 Q9P0U3 1/20 0.42
BCL2L1 Q07817 2/20 0.41

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
SCHEMBL4368303 0.98 MCL1 (0.51) MCL1HSD17B10CYP2C9CYP2D6MPL
SCHEMBL16874351 0.85 CYP2D6 (0.50) MCL1HSD17B10CYP2C9CYP2D6MPL
SCHEMBL7202860 0.84 HSD17B10 (0.50) MCL1HSD17B10CYP2C9CYP2D6MPL
SCHEMBL1808591 0.81 MCL1 (0.51) MCL1HSD17B10CYP2C9CYP2D6MPL
SCHEMBL1808593 0.81 MCL1 (0.73) MCL1HSD17B10CYP2C9CYP2D6MPL
SCHEMBL28897798 0.81 PTPN1 (0.45) MCL1HSD17B10CYP2C9CYP2D6MPL
SCHEMBL7206515 0.80 MCL1 (0.50) MCL1HSD17B10CYP2C9CYP2D6MPL
SCHEMBL7207391 0.80 SENP2 (0.56) MCL1HSD17B10CYP2C9CYP2D6MPL
SCHEMBL29417867 0.76 HPGD (0.57) HSD17B10CYP2C9KDM4EMEN1ALDH1A1
SCHEMBL31401764 0.76 HPGD (0.57) HSD17B10CYP2C9KDM4EMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0432489-A2 Heat-adhesive composite fiber and nonwoven fabric made by using same TEIJIN LIMITED (JP) 1991-06-19 EP disclosed