SCHEMBL6599719

SCHEMBL6599719

O=C(O)c1cc2ccccc2n1Cc1cnc(Cl)c(Cl)c1

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 17/20 0.70
KMT2A Q03164 1/20 0.55
CCR9 P51686 1/20 0.53
GPR35 Q9HC97 1/20 0.51
ABCB11 O95342 1/20 0.51

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
SCHEMBL6597888 0.86 CCR2 (0.71) CCR2ABCB11
SCHEMBL3961949 0.83 CCR2 (1.00) CCR2CCR9GPR35
SCHEMBL5378162 0.83 CCR2 (1.00) CCR2GPR35
SCHEMBL6300906 0.82 CCR2 (1.00) CCR2ABCB11
SCHEMBL3969276 0.79 CCR2 (0.82) CCR2CCR9GPR35
SCHEMBL6598061 0.79 CCR2 (0.79) CCR2ABCB11
SCHEMBL3957310 0.77 CCR2 (1.00) CCR2CCR9GPR35
SCHEMBL3966109 0.77 CCR2 (0.78) CCR2KMT2AGPR35
SCHEMBL29845455 0.77 CCR2 (0.81) CCR2CCR9GPR35
SCHEMBL7008246 0.77 CCR2 (0.81) CCR2GPR35

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
EP-1150952-B1 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2004-10-27 EP disclosed