SCHEMBL4844836

SCHEMBL4844836

NCCC(=O)N[C@@H]1CCN(Cc2ccc(Cl)cc2)C1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 15/20 0.71
SIGMAR1 Q99720 1/20 0.62
NPC1 O15118 1/20 0.61
DRD2 P14416 1/20 0.60
DRD4 P21917 1/20 0.60

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
SCHEMBL4847367 1.00 CCR2 (0.71) CCR2SIGMAR1NPC1DRD2DRD4
SCHEMBL4426840 0.90 CCR2 (0.65) CCR2SIGMAR1NPC1DRD2DRD4
SCHEMBL4846218 0.90 CCR2 (0.65) CCR2SIGMAR1NPC1DRD2DRD4
SCHEMBL4426833 0.90 CCR2 (0.65) CCR2SIGMAR1NPC1DRD2DRD4
SCHEMBL6859397 0.84 DRD2 (0.61) CCR2SIGMAR1DRD2DRD4
SCHEMBL22716940 0.83 DRD2 (0.66) CCR2SIGMAR1DRD2DRD4
SCHEMBL6205049 0.82 SIGMAR1 (0.72) SIGMAR1DRD4
SCHEMBL4848450 0.82 SIGMAR1 (0.77) SIGMAR1
SCHEMBL4847222 0.80 SIGMAR1 (0.66) CCR2SIGMAR1NPC1DRD2DRD4
SCHEMBL4847224 0.80 SIGMAR1 (0.66) CCR2SIGMAR1NPC1DRD2DRD4

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 8 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
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