SCHEMBL14839092

SCHEMBL14839092

CN1C=CC(n2ccc3c(Nc4nc(NCC5(N)CCC5)nnc4C(N)=O)cccc32)N1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SYK P43405 20/20 0.65
KDR P35968 1/20 0.47
AURKB Q96GD4 1/20 0.47
KCNH2 Q12809 1/20 0.38

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
SCHEMBL14839165 0.97 SYK (0.61) SYKKDRAURKB
SCHEMBL14839103 0.82 SYK (0.65) SYKKDRAURKBKCNH2
SCHEMBL15935646 0.81 SYK (0.71) SYK
SCHEMBL15910592 0.79 SYK (1.00) SYKKDRAURKB
SCHEMBL14839148 0.79 SYK (0.77) SYKKDRAURKB
SCHEMBL16253442 0.76 SYK (0.65) SYKKDRAURKB
SCHEMBL15935613 0.76 SYK (0.94) SYKKDRAURKB
SCHEMBL16142232 0.72 SYK (0.57) SYKKDRAURKBKCNH2
SCHEMBL14839171 0.71 SYK (0.63) SYKKDRAURKB
SCHEMBL16743210 0.69 SYK (0.61) SYKKDRAURKB

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-2013047813-A1 1,2,4-TRIAZINE-6-CARBOXAMIDE DERIVATIVE 大鵬薬品工業株式会社 (JP) 2013-04-04 WO disclosed