SCHEMBL7683277

SCHEMBL7683277

O=C(O)c1cc2sc(-c3cccs3)cc2n1Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 4/20 0.65
CCR2 P41597 17/20 0.56

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
SCHEMBL7676176 0.86 MAPT (0.54) ABCB11
SCHEMBL7682483 0.81 CCR2 (0.58) ABCB11CCR2
SCHEMBL6307939 0.80 CCR2 (0.73) ABCB11CCR2
SCHEMBL6302409 0.80 CCR2 (0.72) ABCB11CCR2
SCHEMBL6300354 0.80 CCR2 (0.73) ABCB11CCR2
SCHEMBL7682880 0.80 ABCB11 (0.67) ABCB11CCR2
SCHEMBL7680370 0.80 ABCB11 (0.67) ABCB11CCR2
SCHEMBL7673214 0.79 ABCB11 (1.00) ABCB11CCR2
SCHEMBL4093522 0.75 CCR2 (0.53) ABCB11CCR2
SCHEMBL4104997 0.72 CCR2 (0.53) ABCB11CCR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6479527-B1 Bicyclic pyrrole derivatives as MCP-1 inhibitors ASTRAZENECA UK LIMITED (GB) 2002-11-12 US disclosed
EP-1056451-A1 BICYCLIC PYRROLE DERIVATIVES AS MCP-1 INHIBITORS AstraZeneca UK Limited (GB) 2000-12-06 EP disclosed
WO-1999040914-A1 BICYCLIC PYRROLE DERIVATIVES AS MCP-1 INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-08-19 WO disclosed