SCHEMBL1592217

SCHEMBL1592217

C=CC(=O)Nc1ccc(Nc2cc(S(=O)(=O)O)cc3c2C(=O)c2ccccc2C3=O)c(S(=O)(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHAT P28329 4/20 0.43
▸ USP2 O75604 1/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ PHLPP2 Q6ZVD8 2/20 0.42
▸ ENPP3 O14638 1/20 0.42
▸ ENPP1 P22413 1/20 0.42
▸ GNG2 P59768 5/20 0.41
▸ GNB1 P62873 5/20 0.41
▸ HPGDS O60760 1/20 0.41
▸ CYP1A2 P05177 4/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ HIF1A Q16665 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ PGAM1 P18669 1/20 0.39
▸ THRB P10828 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ ALOX15 P16050 2/20 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
SCHEMBL1592195 0.85 PHLPP2 (0.46) CHATUSP2APEX1PHLPP2ENPP3
SCHEMBL1592676 0.84 PHLPP2 (0.62) CHATUSP2APEX1PHLPP2ENPP3
SCHEMBL11119700 0.82 TGM2 (0.41) THRBPKMRORC
SCHEMBL11119697 0.73 GNG2 (0.70) CHATPHLPP2ENPP3ENPP1GNG2
SCHEMBL2609744 0.72 PHLPP2 (0.53) PHLPP2GNG2GNB1CYP1A2HSD17B10
SCHEMBL28221208 0.72 PHLPP2 (0.48) CHATUSP2APEX1PHLPP2GNG2
SCHEMBL2817311 0.71 THRB (0.68) CYP1A2CYP2C19THRBPKMCYP2C9
SCHEMBL16977398 0.71 GSTO1 (0.55) LMNAGSTO1
SCHEMBL28322468 0.71 P2RY2 (0.56) CHATUSP2APEX1PHLPP2ENPP3
SCHEMBL28195405 0.70 P2RY4 (0.51) GNG2GNB1CYP1A2MAPK1LMNA

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
US-20110092659-A1 Improved Method For Making Tinted Polymers COGNIS IP MANAGEMENT GMBH (DE) 2011-04-21 — — US disclosed
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