SCHEMBL16743248

SCHEMBL16743248

NC(=O)c1nnc(N[C@@H]2CCOC[C@@H]2N)nc1Nc1cccc(-n2nccn2)c1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 0.79
▸ KCNH2 Q12809 4/20 0.79
▸ AURKB Q96GD4 2/20 0.58
▸ KDR P35968 1/20 0.58
▸ JAK2 O60674 1/20 0.58
▸ LCK P06239 1/20 0.58
▸ YES1 P07947 1/20 0.58
▸ LYN P07948 1/20 0.58
▸ FGR P09769 1/20 0.58
▸ SRC P12931 1/20 0.58
▸ PRKCA P17252 1/20 0.58
▸ FLT3 P36888 1/20 0.58
▸ ZAP70 P43403 1/20 0.58
▸ MAP3K9 P80192 1/20 0.58
▸ PAK5 Q9P286 1/20 0.58
▸ MAPK3 P27361 1/20 0.55
▸ MAPK1 P28482 1/20 0.55

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
SCHEMBL16743150 0.88 SYK (1.00) SYKKCNH2JAK2LCKYES1
SCHEMBL14958529 0.86 SYK (0.79) SYKKCNH2AURKBKDRJAK2
SCHEMBL1354024 0.86 SYK (1.00) SYKKCNH2AURKBJAK2LCK
SCHEMBL2627324 0.86 SYK (1.00) SYKKCNH2AURKBJAK2LCK
SCHEMBL16743287 0.85 SYK (0.70) SYKKCNH2AURKBKDRJAK2
SCHEMBL16743184 0.84 SYK (0.76) SYKKCNH2AURKBKDRMAPK3
SCHEMBL2713074 0.82 SYK (0.78) SYKKCNH2AURKBJAK2LCK
SCHEMBL2627143 0.82 SYK (0.86) SYKKCNH2AURKBJAK2LCK
SCHEMBL10272383 0.82 SYK (0.75) SYKKCNH2AURKBJAK2LCK
SCHEMBL2714029 0.82 SYK (0.75) SYKKCNH2AURKBJAK2LCK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9040530-B2 1,2,4-triazine-6-carboxamide kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2015-05-26 — — US disclosed
US-9040530-B2 1,2,4-triazine-6-carboxamide kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2015-05-26 — — US disclosed
Send feedback