SCHEMBL7682880

SCHEMBL7682880

Cc1cc2c(cc(C(=O)O)n2Cc2ccc(Cl)c(Cl)c2)s1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 4/20 0.67
CCR2 P41597 16/20 0.59

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
SCHEMBL7680502 0.86 TP53 (0.58) ABCB11
SCHEMBL7680370 0.85 ABCB11 (0.67) ABCB11CCR2
SCHEMBL7675047 0.83 TP53 (0.51) ABCB11CCR2
SCHEMBL7673214 0.80 ABCB11 (1.00) ABCB11CCR2
SCHEMBL7683277 0.80 ABCB11 (0.65) ABCB11CCR2
SCHEMBL7682483 0.77 CCR2 (0.58) ABCB11CCR2
SCHEMBL6303320 0.77 CCR2 (0.80) ABCB11CCR2
SCHEMBL6303108 0.77 CCR2 (0.79) ABCB11CCR2
SCHEMBL3750485 0.76 HSD17B10 (0.64)
SCHEMBL7691746 0.76 ABCB11 (1.00) 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 1 patent. 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