SCHEMBL4841184

SCHEMBL4841184

O=C(CNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCC1CCN(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 15/20 0.84
KCNH2 Q12809 4/20 0.63
CACNA1I Q9P0X4 4/20 0.63
RHOC P08134 1/20 0.56
RHOA P61586 1/20 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
SCHEMBL4842675 0.92 CCR2 (1.00) CCR2KCNH2CACNA1I
SCHEMBL4856198 0.86 CCR2 (0.90) CCR2
SCHEMBL4848457 0.84 CCR2 (1.00) CCR2
SCHEMBL4844526 0.83 CCR2 (0.84) CCR2
SCHEMBL4844547 0.83 CCR2 (0.84) CCR2
SCHEMBL4848758 0.83 CCR2 (1.00) CCR2KCNH2CACNA1I
SCHEMBL4840112 0.83 CCR2 (0.85) CCR2KCNH2CACNA1I
SCHEMBL4845986 0.83 CCR2 (0.85) CCR2KCNH2CACNA1I
SCHEMBL4848349 0.83 CCR2 (0.85) CCR2KCNH2CACNA1I
SCHEMBL6205241 0.82 CCR2 (0.83) CCR2KCNH2CACNA1I

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7390830-B1 Remedies or prophylactics for diseases in association with chemokines TEIJIN LIMITED (JP) 2008-06-24 US disclosed
EP-1179341-B1 REMEDIES OR PREVENTIVES FOR DISEASES IN ASSOCIATION WITH CHEMOKINES TEIJIN LTD (JP) 2005-11-09 EP disclosed
EP-1553085-A1 Cyclic amine derivatives and their use as drugs TEIJIN LIMITED (JP) 2005-07-13 EP disclosed
EP-1535909-A2 Cyclic amine derivatives and their use as drugs TEIJIN LIMITED (JP) 2005-06-01 EP disclosed
CN-1384743-A Remedies or preventives for diseases in association with chemokines TEIJIN LTD (JP) 2002-12-11 CN disclosed
US-6451842-B1 Cyclic amine derivatives and their use as drugs DUPONT PHARMACEUTICALS COMPANY 2002-09-17 US disclosed
US-6410566-B1 ATHEROSCLEROSIS; ANTIARTHRITIC AGENTS TEIJIN LIMITED (JP) 2002-06-25 US disclosed
US-6362177-B1 INHIBITION OF CHEMOKINE BINDING TEIJIN LIMITED (JP) 2002-03-26 US disclosed
EP-1179341-A1 REMEDIES OR PREVENTIVES FOR DISEASES IN ASSOCIATION WITH CHEMOKINES TEIJIN LIMITED (JP) 2002-02-13 EP disclosed