SCHEMBL5310337

SCHEMBL5310337

O=C(CNC(=O)c1cccc(C(F)(F)F)c1)NC1CCN(C2CCNCC2)C1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 20/20 0.71
KCNH2 Q12809 6/20 0.70

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
SCHEMBL1360410 1.00 CCR2 (0.71) CCR2KCNH2
SCHEMBL13528042 0.96 CCR2 (0.67) CCR2KCNH2
SCHEMBL13528052 0.96 CCR2 (0.67) CCR2KCNH2
SCHEMBL3175838 0.96 CCR2 (0.67) CCR2KCNH2
SCHEMBL3187465 0.96 CCR2 (0.67) CCR2KCNH2
SCHEMBL3176151 0.96 CCR2 (0.67) CCR2KCNH2
SCHEMBL1365472 0.95 CCR2 (0.66) CCR2KCNH2
SCHEMBL13271436 0.95 CCR2 (0.71) CCR2KCNH2
SCHEMBL13271423 0.91 CCR2 (0.67) CCR2KCNH2
SCHEMBL13049118 0.90 CCR2 (0.72) CCR2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007053498-A1 COMPOUNDS USEFUL AS ANTAGONISTS OF CCR2 MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-05-10 WO disclosed