SCHEMBL23938568

SCHEMBL23938568

CC(C)C1(C(=O)NCc2cncc(C(F)(F)F)c2)CCC(N2CCC(c3ccc(F)cc3)CC2)CO1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 16/20 0.64
KCNH2 Q12809 12/20 0.64
TACR1 P25103 4/20 0.55

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
SCHEMBL18244776 1.00 CCR2 (0.64) CCR2KCNH2TACR1
SCHEMBL18245003 1.00 CCR2 (0.64) CCR2KCNH2TACR1
SCHEMBL18253085 0.92 CCR2 (0.75) CCR2KCNH2TACR1
SCHEMBL18253081 0.91 CCR2 (0.70) CCR2KCNH2TACR1
SCHEMBL18252940 0.89 CCR2 (0.66) CCR2KCNH2TACR1
SCHEMBL18255023 0.89 CCR2 (0.68) CCR2KCNH2TACR1
SCHEMBL23938596 0.89 CCR2 (0.53) CCR2KCNH2TACR1
SCHEMBL24433874 0.89 CCR2 (0.66) CCR2KCNH2TACR1
SCHEMBL18253113 0.89 CCR2 (0.53) CCR2KCNH2TACR1
SCHEMBL19443148 0.89 CCR2 (0.53) CCR2KCNH2TACR1

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-3297438-B1 CCR2 MODULATORS CHEMOCENTRYX INC (US) 2021-10-20 EP disclosed