SCHEMBL2484233

SCHEMBL2484233

O=C(NCC(=O)N(C1CCC(O)(c2cncs2)CC1)C1CNC1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 20/20 0.65
KCNH2 Q12809 9/20 0.50

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
SCHEMBL2485103 0.86 CCR2 (0.62) CCR2KCNH2
SCHEMBL2482688 0.86 CCR2 (0.54) CCR2KCNH2
SCHEMBL2483850 0.86 CCR2 (0.51) CCR2KCNH2
SCHEMBL2484276 0.85 CCR2 (0.55) CCR2KCNH2
SCHEMBL2481358 0.85 CCR2 (0.67) CCR2KCNH2
SCHEMBL3415338 0.85 CCR2 (0.55) CCR2KCNH2
SCHEMBL3347918 0.84 CCR2 (0.67) CCR2KCNH2
SCHEMBL3719908 0.84 CCR2 (0.61) CCR2KCNH2
SCHEMBL2485172 0.84 CCR2 (0.65) CCR2KCNH2
SCHEMBL2481121 0.83 CCR2 (0.68) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376475-A1 4-AZETIDINYL-1-HETEROARYL-CYCLOHEXANOL ANTAGONISTS OF CCR2 Janssen Pharmaceutica N.V. (BE) 2011-10-19 EP disclosed
WO-2010068663-A1 4-AZETIDINYL-1-HETEROARYL-CYCLOHEXANOL ANTAGONISTS OF CCR2 JANSSEN PHARMACEUTICA NV (BE) 2010-06-17 WO disclosed