SCHEMBL4276587

SCHEMBL4276587

O=C(O)Oc1ccc2c3c(Cl)c(Cl)c(OC(=O)O)c4c(OC(=O)O)c(Cl)c(Cl)c(c5ccc(OC(=O)O)c1c25)c43

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL11482861 0.88
SCHEMBL297251 0.77 KDM4E (0.31)
SCHEMBL14778702 0.75
SCHEMBL3006414 0.73 KDM4E (0.35) CYP1A2
SCHEMBL4873463 0.69 MAPK1 (0.33)
SCHEMBL8723622 0.68 MAPK1 (0.32)
SCHEMBL8726041 0.68
SCHEMBL14778478 0.67 TPMT (0.33)
SCHEMBL2587831 0.67 KDM4E (0.39) CYP1A2
SCHEMBL1039198 0.67 MAPK1 (0.36)

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
WO-2009037283-A1 METHOD FOR PRODUCING SUBSTRATES COATED WITH RYLENE TETRACARBOLIC ACID DIIMIDES BASF SE (DE) 2009-03-26 WO disclosed
EP-0260648-A2 Tetrachloroperylene-3,4,9-10-tetracarboxylic acid diimide pigment and its use BASF Aktiengesellschaft (DE) 1988-03-23 EP disclosed