SCHEMBL16638758

SCHEMBL16638758

Fc1ccc(C(F)F)cc1CBr

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.39
TRPV4 Q9HBA0 1/20 0.32
KIF11 P52732 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
KCNH2 Q12809 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRA2A P08913 1/20 0.30
ADRB3 P13945 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30

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
SCHEMBL23286888 0.83 MRGPRX4 (0.34) DPP4TRPV4KIF11MRGPRX4
SCHEMBL13185576 0.81 TRPV4 (0.35) DPP4TRPV4MRGPRX4KCNH2ADRB1
SCHEMBL20256735 0.81 DPP4 (0.38) DPP4TRPV4KIF11DPP8MRGPRX4
SCHEMBL19634004 0.81 MRGPRX4 (0.36) DPP4KIF11MRGPRX4CYP2D6ADRB1
SCHEMBL19568082 0.81 DPP4 (0.34) DPP4TRPV4KIF11DPP8MRGPRX4
SCHEMBL13160946 0.79 GABRA1 (0.41) DPP4DPP8CYP3A4CYP2D6SLC6A2
SCHEMBL16400368 0.78 TRPV4 (0.32) TRPV4KIF11
SCHEMBL19566851 0.78 HRH4 (0.33) DPP4KCNH2ADRB1ADRA2AADRB3
SCHEMBL20782181 0.76 ADRB1 (0.33) DPP4TRPV4ADRB1ADRA2AADRB3
SCHEMBL29430341 0.75 DPP4 (0.46) DPP4DPP8

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-2161273-B1 Imidazo[4,5-c]pyridine compounds and methods of antiviral treatment LEUVEN K U RES & DEV (BE) 2015-04-15 EP disclosed