SCHEMBL9923374

SCHEMBL9923374

CN(C)Cc1ccc(Cc2cc(C(=O)Nc3ccn(C)n3)cc3c2CC(C)(C)O3)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCK P35557 12/20 0.51
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
WNT1 P04628 1/20 0.35
CLK2 P49760 1/20 0.35
CLK3 P49761 1/20 0.35
GSK3B P49841 1/20 0.35
DYRK1A Q13627 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34

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
SCHEMBL643176 0.85 GCK (0.62) GCKNPC1RAB9A
SCHEMBL15780522 0.84 GCK (0.54) GCKNPC1RAB9AIRAK4
SCHEMBL12101372 0.77 GCK (0.48) GCKNPC1RAB9AALDH1A1LMNA
SCHEMBL644304 0.76 GCK (0.64) GCKNPC1RAB9A
SCHEMBL643753 0.76 GCK (0.58) GCKNPC1RAB9AALDH1A1LMNA
SCHEMBL12101384 0.76 GCK (0.58) GCKNPC1RAB9AALDH1A1LMNA
SCHEMBL644899 0.73 GCK (0.62) GCKNPC1RAB9AALDH1A1LMNA
SCHEMBL642856 0.73 GCK (0.58) GCKNPC1RAB9AALDH1A1IRAK4
SCHEMBL644978 0.73 GCK (0.68) GCK
SCHEMBL644554 0.73 GCK (0.70) GCKNPC1RAB9A

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-2463283-A1 Fused phenyl Amido heterocyclic compounds for the prevention and treatment of glucokinase-mediated diseases Pfizer Products Inc. (US) 2012-06-13 EP disclosed