SCHEMBL4847958

SCHEMBL4847958

COc1ccc(CN2CCC(NC(=O)CNC(=O)c3cc(OC(F)(F)F)ccc3N)C2)cc1O

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 20/20 0.81

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
SCHEMBL4847944 1.00 CCR2 (0.81) CCR2
SCHEMBL6205906 0.88 CCR2 (0.88) CCR2
Hydrochloric Acid SCHEMBL5438847 0.85 CCR2 (0.85) CCR2
Hydrochloric Acid SCHEMBL5438844 0.85 CCR2 (0.85) CCR2
SCHEMBL6204326 0.83 CCR2 (1.00) CCR2
SCHEMBL8183066 0.82 CCR2 (0.72) CCR2
SCHEMBL8183182 0.82 CCR2 (0.71) CCR2
SCHEMBL8177859 0.81 CCR2 (0.70) CCR2
SCHEMBL6205486 0.81 CCR2 (1.00) CCR2
SCHEMBL8169867 0.81 CCR2 (0.70) 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 7 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-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