SCHEMBL6206317

SCHEMBL6206317

Nc1cc(F)c(F)cc1C(=O)NCC(=O)NCC1CCN(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 13/20 0.74
HTR4 Q13639 2/20 0.54
FAAH O00519 1/20 0.49
BCHE P06276 1/20 0.49
ACHE P22303 1/20 0.49
CHRM4 P08173 1/20 0.49
KCNH2 Q12809 1/20 0.48
CACNA1I Q9P0X4 1/20 0.48
KMT2A Q03164 1/20 0.47

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
SCHEMBL4844643 0.94 CCR2 (0.67) CCR2HTR4
SCHEMBL4845881 0.92 CCR2 (0.63) CCR2HTR4KMT2A
SCHEMBL6205584 0.91 CCR2 (0.63) CCR2HTR4FAAHBCHEACHE
SCHEMBL6205964 0.89 CCR2 (0.81) CCR2HTR4FAAHBCHEACHE
SCHEMBL4847632 0.89 CCR2 (0.59) CCR2HTR4KMT2A
SCHEMBL4847407 0.88 CCR2 (0.59) CCR2HTR4KCNH2CACNA1IKMT2A
SCHEMBL6207614 0.88 CCR2 (0.59) CCR2HTR4KCNH2CACNA1I
SCHEMBL4841277 0.86 CCR2 (0.76) CCR2HTR4FAAHBCHEACHE
SCHEMBL4840620 0.86 HTR4 (0.58) CCR2HTR4
SCHEMBL4848457 0.85 CCR2 (1.00) 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