SCHEMBL7052377

SCHEMBL7052377

O=C1CCCc2c1cc(C(=O)O)n2Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 15/20 0.53
ABCB11 O95342 4/20 0.51
BRD4 O60885 1/20 0.50
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49

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
SCHEMBL7947056 0.85 CCR2 (0.55) CCR2ABCB11LMNAMAPTRAB9A
SCHEMBL7049658 0.84 BRD4 (0.50) CCR2BRD4LMNAMAPTRAB9A
SCHEMBL7052102 0.84 CCR2 (0.56) CCR2ABCB11
SCHEMBL7048043 0.83 BRD4 (0.44) CCR2ABCB11BRD4LMNAMAPT
SCHEMBL7047694 0.81 BRD4 (0.50) CCR2BRD4LMNAMAPTRAB9A
SCHEMBL7049651 0.80 RAB9A (0.48) CCR2BRD4LMNAMAPTRAB9A
SCHEMBL7049034 0.80 CCR2 (0.45) CCR2ABCB11
SCHEMBL7048041 0.80 CCR2 (0.45) CCR2ABCB11
SCHEMBL7047693 0.78 CCR2 (0.48) CCR2ABCB11
SCHEMBL7947149 0.78 BRD4 (0.46) CCR2BRD4LMNAMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054667-B1 BICYCLIC PYRROLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTIINFLAMMATORY AND IMMUNOMODULATING AGENTS ASTRAZENECA UK LTD (GB) 2003-04-16 EP disclosed
US-6291507-B1 INHIBITOR OF MONOCYTE CHEMOATTRACTANT PROTEIN-1; INDOLE DERIVATIVES ASTRAZENECA UK LIMITED (GB) 2001-09-18 US disclosed
EP-1054667-A1 BICYCLIC PYRROLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTIINFLAMMATORY AND IMMUNOMODULATING AGENTS AstraZeneca UK Limited (GB) 2000-11-29 EP disclosed
WO-1999040913-A1 CHEMICAL COMPOUNDS ASTRAZENECA UK LIMITED (GB) 1999-08-19 WO disclosed