SCHEMBL8970038

SCHEMBL8970038

Cc1cnc(N)c(C(=O)c2cccc(N3CCCN(CCO)CC3)n2)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 16/20 0.56
PRKCA P17252 3/20 0.47
PRKCD Q05655 3/20 0.47
PIM1 P11309 1/20 0.43
HTR1A P08908 2/20 0.41
HTR2A P28223 2/20 0.41
HTR2C P28335 1/20 0.41
DRD3 P35462 1/20 0.41
HSD17B14 Q9BPX1 1/20 0.39

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
SCHEMBL11993693 0.96 PRKCQ (0.52) PRKCQPRKCAPRKCDHTR1AHTR2A
SCHEMBL9010807 0.89 PRKCQ (0.54) PRKCQPRKCAPRKCDPIM1HSD17B14
SCHEMBL8969919 0.87 PRKCQ (0.52) PRKCQPRKCAPRKCD
SCHEMBL8970237 0.86 PRKCQ (0.58) PRKCQPRKCAPRKCDHSD17B14
SCHEMBL11993696 0.85 PRKCQ (0.49) PRKCQPRKCAPRKCDHTR1AHTR2A
SCHEMBL9008438 0.85 PRKCQ (0.50) PRKCQPRKCAPRKCDPIM1
SCHEMBL8969935 0.81 PRKCQ (0.54) PRKCQPRKCAPRKCD
SCHEMBL13857242 0.81 PRKCQ (0.47) PRKCQPRKCAPRKCDPIM1HTR1A
SCHEMBL8185355 0.81 PRKCQ (0.71) PRKCQPRKCAPRKCDPIM1
SCHEMBL16071357 0.81 PRKCQ (0.53) PRKCQPRKCAPRKCDHSD17B14

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
US-8188071-B2 Amino substituted pyridines as potent kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed