SCHEMBL8972954

SCHEMBL8972954

NCC(=O)Nc1ccc(Nc2cc(S(=O)(=O)O)c(N)c3c2C(=O)c2ccccc2C3=O)c(S(=O)(=O)O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 2/20 0.63
▸ GNG2 P59768 5/20 0.63
▸ GNB1 P62873 5/20 0.63
▸ HPGDS O60760 1/20 0.58
▸ CHAT P28329 4/20 0.57
▸ P2RY4 P51582 3/20 0.56
▸ USP2 O75604 1/20 0.56
▸ APEX1 P27695 1/20 0.56
▸ CYP1A2 P05177 2/20 0.56
▸ CYP2C9 P11712 2/20 0.56
▸ ALOX15 P16050 2/20 0.56
▸ HSD17B10 Q99714 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ HIF1A Q16665 1/20 0.55
▸ ENPP3 O14638 1/20 0.54
▸ ENPP1 P22413 1/20 0.54

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
SCHEMBL1592676 0.85 PHLPP2 (0.62) PHLPP2GNG2GNB1HPGDSCHAT
SCHEMBL11781902 0.85 PHLPP2 (0.65) PHLPP2GNG2GNB1HPGDSCHAT
SCHEMBL1592192 0.84 PHLPP2 (0.67) PHLPP2GNG2GNB1HPGDSCHAT
SCHEMBL12172884 0.84 GNG2 (0.61) PHLPP2GNG2GNB1HPGDSCHAT
SCHEMBL11321111 0.84 GNG2 (0.81) PHLPP2GNG2GNB1HPGDSCHAT
SCHEMBL18493688 0.83 GNG2 (0.60) PHLPP2GNG2GNB1HPGDSCHAT
SCHEMBL18089411 0.83 PHLPP2 (0.65) PHLPP2GNG2GNB1HPGDSCHAT
SCHEMBL13214010 0.83 GNG2 (0.78) PHLPP2GNG2GNB1HPGDSCHAT
SCHEMBL8647025 0.82 GNG2 (0.63) PHLPP2GNG2GNB1HPGDSCHAT
SCHEMBL3019527 0.82 GNG2 (0.77) PHLPP2GNG2GNB1HPGDSCHAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0481449-B1 Ink compositions for ink jet recording SUMITOMO CHEMICAL CO (JP) 1996-03-27 — — EP disclosed
EP-0481449-A2 Ink compositions for ink jet recording SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-04-22 — — EP disclosed
EP-0167219-B1 FIBER-REACTIVE COMPOUND HAVING BOTH PYRIDINIOTRIAZINYL AND VINYLSULFONE TYPE GROUPS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-09-28 — — EP disclosed
US-4626589-A Organic dye compound having both pyridiniotriazinyl and vinylsulfone type fiber-reactive groups SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-12-02 — — US disclosed
EP-0167219-A1 Fiber-reactive compound having both pyridiniotriazinyl and vinylsulfone type groups SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-01-08 — — EP disclosed
US-4263206-A Reactive dyestuffs containing chlorine or fluorine substituents and one or more 1,3-dicyanobenzene radicals linked to the dyestuff at the 2-, 4- or 6-position IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-04-21 — — US disclosed
US-4213899-A FOR CELLULOSE IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-07-22 — — US disclosed
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