SCHEMBL6432404

SCHEMBL6432404

N#Cc1cccc(Cn2c(C(=O)O)cc3c(OCc4ccccc4)cccc32)c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 8/20 0.57
PPIA P62937 1/20 0.46
MRGPRX4 Q96LA9 2/20 0.43
F10 P00742 1/20 0.43
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
ALKBH1 Q13686 1/20 0.43
FEN1 P39748 1/20 0.43
SRD5A2 P31213 1/20 0.42

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
SCHEMBL6433663 0.88 F10 (0.50) CCR2PPIAMRGPRX4F10FFAR1
SCHEMBL6433546 0.87 CCR2 (0.67) CCR2F10FEN1
SCHEMBL6432935 0.82 CCR2 (0.64) CCR2F10FEN1
SCHEMBL6433702 0.82 F10 (0.54) F10
SCHEMBL6432960 0.81 CCR2 (0.65) CCR2F10FEN1
SCHEMBL6432749 0.81 CCR2 (0.62) CCR2FEN1
SCHEMBL6432803 0.80 CCR2 (0.70) CCR2F10FFAR1FFAR4SRD5A2
SCHEMBL6433076 0.80 CCR2 (0.77) CCR2F10FEN1
SCHEMBL6433700 0.78 CCR2 (0.54) CCR2F10
SCHEMBL6594219 0.77 CCR2 (0.57) CCR2

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-1042287-B1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA AVENTIS PHARMA GMBH (DE) 2005-04-20 EP disclosed
US-6337344-B1 ANTICOAGULANTS AND ENZYME INHIBITORS FOR CARDIOVASCULAR DISORDERS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-01-08 US disclosed
EP-1042287-A1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA Aventis Pharma Deutschland GmbH (DE) 2000-10-11 EP disclosed
WO-1999033800-A1 INDOLE DERIVATIVES AS INHIBITORS OR FACTOR XA AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-08 WO disclosed