SCHEMBL747415

SCHEMBL747415

CCOC1CN(C2CCC(O)(c3cccc(F)c3)CC2)CC1NC(=O)CNC(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.88

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 19/20 0.88
KCNH2 Q12809 15/20 0.88

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
SCHEMBL746745 1.00 CCR2 (0.88) CCR2KCNH2
SCHEMBL746746 1.00 CCR2 (0.88) CCR2KCNH2
SCHEMBL744288 0.94 CCR2 (0.89) CCR2KCNH2
SCHEMBL744287 0.94 CCR2 (0.89) CCR2KCNH2
SCHEMBL13048920 0.94 CCR2 (1.00) CCR2KCNH2
SCHEMBL765257 0.94 CCR2 (1.00) CCR2KCNH2
SCHEMBL746250 0.94 CCR2 (1.00) CCR2KCNH2
SCHEMBL746249 0.94 CCR2 (1.00) CCR2KCNH2
SCHEMBL744121 0.93 CCR2 (0.88) CCR2KCNH2
SCHEMBL744122 0.93 CCR2 (0.88) 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
EP-2431357-A2 3-Aminopyrrolidine Derivatives as Modulators of Chemokine Receptors Incyte Corporation (US) 2012-03-21 EP claimed