SCHEMBL9607464

SCHEMBL9607464

CC1(C)CN=C(c2cc(F)c(Cl)cc2N)O1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.32
ALPL P05186 1/20 0.31
SLC6A4 P31645 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
SCHEMBL9607342 0.94 CNR2 (0.32) CNR2
SCHEMBL9607484 0.88 CNR2 (0.34) CNR2
SCHEMBL9607169 0.78 IDO1 (0.39)
SCHEMBL23580463 0.67 CNR2 (0.34) CNR2
SCHEMBL20093145 0.64 AAK1 (0.34) CNR2
SCHEMBL7998116 0.63 NISCH (0.39)
SCHEMBL6722024 0.63 CNR2 (0.36) CNR2
SCHEMBL6559969 0.63 ALDH1A1 (0.51) CNR2
SCHEMBL30888694 0.63 ALDH1A1 (0.51) CNR2
SCHEMBL20092180 0.62 TYK2 (0.44)

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
WO-2012069856-A1 ANTIMALARIAL COMPOUNDS LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2012-05-31 WO disclosed