SCHEMBL15048477

SCHEMBL15048477

CC1COCCC1NC1CCC(C(=O)N2CCN(c3nccc(C(F)(F)F)n3)CC2)(C(C)C)C1

nearest known ligand 0.82

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 20/20 0.82
KCNH2 Q12809 11/20 0.82
CCR5 P51681 6/20 0.82

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
SCHEMBL14011061 1.00 CCR2 (0.82) CCR2KCNH2CCR5
SCHEMBL3326125 1.00 CCR2 (0.82) CCR2KCNH2CCR5
SCHEMBL18901440 1.00 CCR2 (0.82) CCR2KCNH2CCR5
SCHEMBL13627660 0.90 CCR2 (1.00) CCR2KCNH2CCR5
SCHEMBL3322708 0.90 CCR2 (0.79) CCR2KCNH2CCR5
SCHEMBL14011062 0.90 CCR2 (0.79) CCR2KCNH2CCR5
SCHEMBL3987100 0.90 CCR2 (1.00) CCR2KCNH2CCR5
SCHEMBL4146068 0.90 CCR2 (1.00) CCR2KCNH2CCR5
SCHEMBL13335024 0.89 CCR2 (0.66) CCR2KCNH2CCR5
SCHEMBL3325003 0.89 CCR2 (0.66) CCR2KCNH2CCR5

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-1763351-B9 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE HOLDINGS CORP (US) 2017-05-31 EP claimed
EP-1763351-B1 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE HOLDINGS CORP (US) 2016-11-30 EP claimed
US-8470827-B2 3-aminocyclopentanecarboxamides as modulators of chemokine receptors INCYTE CORPORATION (US) 2013-06-25 US claimed