SCHEMBL7674077

SCHEMBL7674077

O=C(O)c1cc2occc2n1S(=O)(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.62
NOD1 Q9Y239 1/20 0.40
TSHR P16473 3/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
ABCB11 O95342 1/20 0.37
ACLY P53396 1/20 0.37
KMT2A Q03164 2/20 0.37
BCL2 P10415 1/20 0.36
BID P55957 1/20 0.36
MCL1 Q07820 1/20 0.36
MEN1 O00255 1/20 0.36
KDM1A O60341 1/20 0.36
RCOR1 Q9UKL0 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 1/20 0.36
CTSG P08311 1/20 0.35
CMA1 P23946 1/20 0.35
FLT1 P17948 1/20 0.34
FLT4 P35916 1/20 0.34
KDR P35968 1/20 0.34

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
SCHEMBL7516484 0.86 MAPT (0.50) CCR2TSHRMAPT
SCHEMBL6959828 0.77 CCR2 (1.00) CCR2NOD1TSHRACLYKMT2A
SCHEMBL6953098 0.76 CCR2 (0.75) CCR2ABCB11ACLYBCL2BID
SCHEMBL6596517 0.75 CCR2 (0.73) CCR2NOD1ABCB11ACLYBCL2
SCHEMBL7050238 0.70 CCR2 (0.56) CCR2NOD1TSHRPTGDR2KMT2A
SCHEMBL7829429 0.67 CCR2 (0.66) CCR2ABCB11ACLYKMT2ABCL2
SCHEMBL1340122 0.66 KDM1A (0.64) TSHRMCL1KDM1ARCOR1L3MBTL1
SCHEMBL6963990 0.63 CCR2 (0.74) CCR2NOD1KMT2ABCL2BID
SCHEMBL13802522 0.63 CCR2 (0.76) CCR2NOD1TSHRACLYBCL2
SCHEMBL6964954 0.63 CCR2 (0.56) CCR2NOD1ACLYFLT1FLT4

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