SCHEMBL23938481

SCHEMBL23938481

CC(C)C1(C)CCC(N2CCC(c3ccc(F)cc3)CC2)CO1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.50
CCR2 P41597 3/20 0.50
TACR1 P25103 15/20 0.43
ADAMTS5 Q9UNA0 1/20 0.40
DPP4 P27487 1/20 0.40
DPP8 Q6V1X1 1/20 0.40
DPP9 Q86TI2 1/20 0.40

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
SCHEMBL24433932 0.85 KCNH2 (0.48) KCNH2CCR2TACR1ADAMTS5DPP4
SCHEMBL21900723 0.85 KCNH2 (0.48) KCNH2CCR2TACR1ADAMTS5DPP4
SCHEMBL18252874 0.84 KCNH2 (0.48) KCNH2CCR2TACR1ADAMTS5DPP4
SCHEMBL18244998 0.82 TACR1 (0.46) KCNH2CCR2TACR1ADAMTS5DPP4
SCHEMBL18252890 0.79 KCNH2 (0.46) KCNH2CCR2TACR1
SCHEMBL24433859 0.79 TACR1 (0.43) KCNH2CCR2TACR1
SCHEMBL21900422 0.79 TACR1 (0.43) KCNH2CCR2TACR1
SCHEMBL19443100 0.79 TACR1 (0.43) KCNH2CCR2TACR1
SCHEMBL3863239 0.78 KCNH2 (0.63) KCNH2CCR2TACR1
SCHEMBL13645885 0.78 KCNH2 (0.63) KCNH2CCR2TACR1

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