SCHEMBL12733116

SCHEMBL12733116

C=CS(=O)(=O)c1cccc(Nc2cc(S(=O)(=O)O)c(N)c3c2C(=O)C2C=CC=CC2C3=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNG2 P59768 5/20 0.53
▸ GNB1 P62873 5/20 0.53
▸ PHLPP2 Q6ZVD8 2/20 0.53
▸ CYP1A2 P05177 2/20 0.53
▸ CYP2C9 P11712 2/20 0.53
▸ ALOX15 P16050 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ P2RY4 P51582 6/20 0.47
▸ CHAT P28329 4/20 0.45
▸ ENPP3 O14638 1/20 0.45
▸ ENPP1 P22413 1/20 0.45
▸ USP2 O75604 1/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ HPGDS O60760 1/20 0.38

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
SCHEMBL12733118 0.82 GNG2 (0.49) GNG2GNB1PHLPP2CYP1A2CYP2C9
SCHEMBL625105 0.82 GNG2 (0.78) GNG2GNB1PHLPP2CYP1A2CYP2C9
SCHEMBL12733117 0.82 GNG2 (0.48) GNG2GNB1PHLPP2CYP1A2CYP2C9
SCHEMBL24645555 0.79 GNG2 (0.59) GNG2GNB1PHLPP2CYP1A2CYP2C9
Uniblue A SCHEMBL19921895 0.72 P2RY4 (0.71) P2RY4P2RY2P2RY12P2RY6CDK2
Uniblue A SCHEMBL29533348 0.72 P2RY4 (0.71) P2RY4P2RY2P2RY12P2RY6CDK2
SCHEMBL13214229 0.71 GNG2 (0.87) GNG2GNB1PHLPP2CYP1A2CYP2C9
SCHEMBL8656578 0.71 GNG2 (0.75) GNG2GNB1PHLPP2CYP1A2CYP2C9
SCHEMBL791497 0.70 GNG2 (0.85) GNG2GNB1PHLPP2CYP1A2CYP2C9
SCHEMBL2781947 0.70 GNG2 (1.00) GNG2GNB1PHLPP2CYP1A2CYP2C9

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-7919221-B2 colorant comprises an azo dye having at least one reactive group selected from SO2CnH2nOSO3H, NHCOCnH2nOSO3H, NHSO2CnH2nOSO3H, COCnH2nOSO3H and SO2CH .dbd. CH2 ( n=1-4 ); a resin such as Laurylmethacrylate/methylmethacrylate/methacrylic;acid (80/10/10) copolymer containing isoparaffinic solvent RICOH COMPANY, LTD. (JP) 2011-04-05 — — US disclosed
US-20080199791-A1 ELECTROPHOTOGRAPHIC PRINTING TONER, ELECTROPHOTOGRAPHIC PRINTING METHOD AND LIQUID DEVELOPER FOR ELECTROPHOTOGRAPHIC PRINTING RICOH COMPANY, LTD. (JP) 2008-08-21 — — US disclosed
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