SCHEMBL6205964

SCHEMBL6205964

Nc1ccc(Cl)cc1C(=O)NCC(=O)NCC1CCN(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 15/20 0.81
MCHR1 Q99705 1/20 0.53
HTR4 Q13639 2/20 0.52
FAAH O00519 1/20 0.52
BCHE P06276 1/20 0.52
ACHE P22303 1/20 0.52
KCNH2 Q12809 1/20 0.51
CACNA1I Q9P0X4 1/20 0.51

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
SCHEMBL4841277 0.92 CCR2 (0.76) CCR2HTR4FAAHBCHEACHE
SCHEMBL4848391 0.90 CCR2 (0.68) CCR2HTR4FAAHBCHEACHE
SCHEMBL4848457 0.90 CCR2 (1.00) CCR2
SCHEMBL4840598 0.89 CCR2 (0.74) CCR2HTR4
SCHEMBL6206317 0.89 CCR2 (0.74) CCR2HTR4FAAHBCHEACHE
SCHEMBL6205769 0.87 CCR2 (0.77) CCR2HTR4FAAHBCHEACHE
SCHEMBL4844643 0.84 CCR2 (0.67) CCR2HTR4
SCHEMBL4842893 0.83 CCR2 (1.00) CCR2
SCHEMBL4842873 0.83 CCR2 (1.00) CCR2
SCHEMBL4844890 0.82 CCR2 (0.84) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1553085-A1 Cyclic amine derivatives and their use as drugs TEIJIN LIMITED (JP) 2005-07-13 EP claimed
EP-1535909-A2 Cyclic amine derivatives and their use as drugs TEIJIN LIMITED (JP) 2005-06-01 EP claimed
US-6410566-B1 ATHEROSCLEROSIS; ANTIARTHRITIC AGENTS TEIJIN LIMITED (JP) 2002-06-25 US claimed