SCHEMBL27967352

SCHEMBL27967352

O=C(O)Cc1c(S(=O)(=O)O)ccc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.61
ALDH1A1 P00352 3/20 0.61
GAA P10253 2/20 0.61
HSD17B10 Q99714 2/20 0.61
GLA P06280 1/20 0.61
HPGD P15428 1/20 0.61
TDP1 Q9NUW8 1/20 0.49
AKR1B1 P15121 2/20 0.48
CTRB1 P17538 1/20 0.44
MPL P40238 1/20 0.43
CTRC Q99895 1/20 0.43
CYP2D6 P10635 1/20 0.41
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
MAPT P10636 2/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
POLB P06746 1/20 0.40
GPR35 Q9HC97 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL14991517 0.83 CTRB1 (0.49) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL9558384 0.83 HSD17B10 (0.53) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL10483753 0.81 HSD17B10 (0.52) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL10483759 0.81 HSD17B10 (0.52) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL11777460 0.81 HSD17B10 (0.52) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL31069880 0.80 NCEH1 (0.47) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL8681169 0.80 CTRB1 (0.47) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL1702486 0.80 CTRB1 (0.47) KDM4EALDH1A1GAAHSD17B10GLA
SCHEMBL12363940 0.80 NCEH1 (0.47) KDM4EALDH1A1GAAHSD17B10GLA
Ammonia Solution, Strong SCHEMBL11294453 0.79 CTRB1 (0.43) KDM4EALDH1A1GAAHSD17B10GLA

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
CN-103809375-A Photosensitive resin composition GENENCHIP 2014-05-21 CN disclosed