SCHEMBL28065849

SCHEMBL28065849

O=S(=O)(O)c1ccc2ccc(O)cc2c1S(=O)(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPL P40238 3/20 0.49
LMNA P02545 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
HIF1A Q16665 1/20 0.41
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
PTGES O14684 1/20 0.40
CTRB1 P17538 1/20 0.40
CYP2D6 P10635 1/20 0.39
CTRC Q99895 1/20 0.39
CA2 P00918 1/20 0.39
NT5E P21589 1/20 0.38
CASP6 P55212 2/20 0.37
NSD2 O96028 1/20 0.37
MMP14 P50281 1/20 0.37
MCL1 Q07820 2/20 0.37
EGFR P00533 1/20 0.36
PTGS1 P23219 1/20 0.36
ALPL P05186 1/20 0.36

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
SCHEMBL28065912 0.89 MPL (0.49) MPLLMNAHSD17B10HPGDHIF1A
SCHEMBL10683756 0.85 CYP2D6 (0.44) MPLLMNAHSD17B10HPGDHIF1A
SCHEMBL8066094 0.85 MPL (0.49) MPLLMNAHSD17B10HPGDHIF1A
SCHEMBL27999033 0.81 ALDH1A1 (0.56) LMNAHSD17B10HPGDHIF1ANT5E
SCHEMBL9334347 0.79 NT5E (0.56) HSD17B10HPGDCTRB1CA2NT5E
SCHEMBL1807925 0.79 MPL (0.51) MPLESR1ESR2PTGESCTRB1
SCHEMBL4650562 0.78 MPL (0.50) MPLLMNAHSD17B10HPGDHIF1A
SCHEMBL4670226 0.78 ESR1 (0.39) MPLLMNAESR1ESR2PTGES
SCHEMBL9175976 0.78 MPL (0.50) MPLESR1ESR2PTGESCTRB1
SCHEMBL11189769 0.78 MPL (0.50) MPLESR1ESR2PTGESCTRB1

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-102566269-B Coloured composition, colour filter and display element JSR株式会社 2016-06-15 CN disclosed