SCHEMBL6595461

SCHEMBL6595461

O=C(O)c1cc2ccccc2n1Cc1ccc(F)c(F)c1

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 17/20 0.73
PLA2G10 O15496 1/20 0.55
GPR35 Q9HC97 1/20 0.52

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
SCHEMBL6600760 0.88 CCR2 (0.79) CCR2
SCHEMBL6598061 0.88 CCR2 (0.79) CCR2
SCHEMBL7008246 0.86 CCR2 (0.81) CCR2PLA2G10GPR35
SCHEMBL3209668 0.85 CCR2 (0.74) CCR2
SCHEMBL3961949 0.85 CCR2 (1.00) CCR2GPR35
SCHEMBL5378162 0.84 CCR2 (1.00) CCR2PLA2G10GPR35
SCHEMBL27811964 0.84 CCR2 (0.76) CCR2PLA2G10GPR35
SCHEMBL6300906 0.81 CCR2 (1.00) CCR2
SCHEMBL3957310 0.81 CCR2 (1.00) CCR2PLA2G10GPR35
SCHEMBL3969276 0.81 CCR2 (0.82) CCR2PLA2G10GPR35

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
EP-1150954-B1 ANTI-IMFLAMMATORY INDOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-10-13 EP disclosed
EP-1003504-B1 INDOLE DERIVATIVES AND THEIR USE AS MCP-1 ANTAGONISTS ASTRAZENECA AB (SE) 2003-07-02 EP disclosed