SCHEMBL14318008

SCHEMBL14318008

Cc1cc(Cc2ccc(Nc3cc(S(=O)(=O)O)c(N)c4c3C(=O)c3ccccc3C4=O)c(C)c2)ccc1Nc1cc(S(=O)(=O)O)c(N)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNG2 P59768 5/20 0.64
▸ GNB1 P62873 5/20 0.64
▸ P2RY4 P51582 9/20 0.61
▸ P2RY2 P41231 5/20 0.61
▸ MET P08581 2/20 0.61
▸ PHLPP2 Q6ZVD8 2/20 0.58
▸ ALDH1A1 P00352 3/20 0.55
▸ HPGD P15428 3/20 0.55
▸ MAPK1 P28482 3/20 0.55
▸ CYP1A2 P05177 2/20 0.55
▸ CYP2C9 P11712 2/20 0.55
▸ ALOX15 P16050 2/20 0.55
▸ HSD17B10 Q99714 2/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ HIF1A Q16665 1/20 0.55
▸ MEN1 O00255 2/20 0.54
▸ NSD2 O96028 2/20 0.54
▸ POLB P06746 2/20 0.54
▸ MAPT P10636 2/20 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
SCHEMBL18867032 0.88 GNG2 (0.71) GNG2GNB1P2RY4P2RY2MET
SCHEMBL11602263 0.86 P2RY4 (0.76) GNG2GNB1P2RY4P2RY2MET
SCHEMBL28444449 0.85 P2RY4 (0.74) GNG2GNB1P2RY4P2RY2MET
SCHEMBL9512742 0.84 GNG2 (0.80) GNG2GNB1P2RY4P2RY2MET
SCHEMBL8631126 0.84 GNG2 (0.63) GNG2GNB1P2RY4P2RY2MET
SCHEMBL11603300 0.83 ALDH1A1 (0.64) GNG2GNB1P2RY4P2RY2MET
SCHEMBL8633432 0.83 GNG2 (0.65) GNG2GNB1P2RY4P2RY2MET
SCHEMBL30371939 0.83 GNG2 (0.79) GNG2GNB1P2RY4P2RY2MET
SCHEMBL18866937 0.83 GNG2 (0.74) GNG2GNB1P2RY4P2RY2MET
SCHEMBL13213972 0.82 P2RY4 (0.78) GNG2GNB1P2RY4P2RY2MET

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
WO-2012171638-A1 ACID DYE MIXTURES FOR POLYAMIDE AND WOOL, CONTAINING DIMER ACID DYES CLARIANT INTERNATIONAL LTD (CH) 2012-12-20 — — WO disclosed
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