SCHEMBL16743356

SCHEMBL16743356

COc1cc(Nc2nc(N[C@@H]3CCOC[C@@H]3N)nnc2C(N)=O)ccc1Cl

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 19/20 0.61
▸ MAPK3 P27361 3/20 0.55
▸ MAPK1 P28482 3/20 0.55
▸ AURKB Q96GD4 3/20 0.53
▸ KDR P35968 1/20 0.53
▸ KCNH2 Q12809 3/20 0.51
▸ JAK2 O60674 2/20 0.51
▸ JAK1 P23458 2/20 0.51
▸ JAK3 P52333 2/20 0.51
▸ LCK P06239 1/20 0.51
▸ LYN P07948 1/20 0.51
▸ ZAP70 P43403 1/20 0.51
▸ TYRO3 Q06418 1/20 0.51
▸ TYK2 P29597 1/20 0.51

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
SCHEMBL16743379 0.89 SYK (0.71) SYKMAPK3MAPK1AURKBKDR
SCHEMBL16743365 0.85 SYK (0.65) SYKMAPK3MAPK1AURKBKDR
SCHEMBL16743268 0.84 SYK (0.74) SYKMAPK3MAPK1AURKBKDR
SCHEMBL16743155 0.83 SYK (0.72) SYKMAPK3MAPK1AURKBKDR
SCHEMBL14838959 0.81 SYK (0.78) SYKMAPK3MAPK1AURKBKDR
SCHEMBL16743287 0.81 SYK (0.70) SYKMAPK3MAPK1AURKBKDR
SCHEMBL16743233 0.81 SYK (0.64) SYKAURKBKCNH2
SCHEMBL16743284 0.80 SYK (0.71) SYKMAPK3MAPK1AURKBKDR
SCHEMBL15910977 0.80 SYK (0.82) SYKMAPK3MAPK1AURKBKDR
SCHEMBL16743597 0.79 SYK (0.62) SYKMAPK3MAPK1AURKBKDR

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