SCHEMBL14976182

SCHEMBL14976182

CCc1cc(Nc2nc(NC(C)C(C)C(N)=O)cnc2C(N)=O)sn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 4/20 0.41
▸ LCK P06239 4/20 0.38
▸ JAK3 P52333 4/20 0.38
▸ CDC7 O00311 1/20 0.34
▸ PLK4 O00444 1/20 0.34
▸ CHEK1 O14757 1/20 0.34
▸ PDPK1 O15530 1/20 0.34
▸ DAPK3 O43293 1/20 0.34
▸ DYRK3 O43781 1/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ ROCK2 O75116 1/20 0.34
▸ RPS6KA5 O75582 1/20 0.34
▸ PRKD3 O94806 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ PAK4 O96013 1/20 0.34
▸ CHEK2 O96017 1/20 0.34
▸ ABL1 P00519 1/20 0.34
▸ PRKCG P05129 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ CDK1 P06493 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
SCHEMBL14956379 0.88 BTK (0.41) BTKLCKJAK3CDC7PLK4
SCHEMBL14956382 0.88 BTK (0.41) BTKLCKJAK3CDC7PLK4
SCHEMBL14955485 0.87 BTK (0.40) BTKLCKJAK3CDC7PLK4
SCHEMBL14955486 0.87 BTK (0.40) BTKLCKJAK3CDC7PLK4
SCHEMBL14976147 0.87 BTK (0.53) BTKLCKJAK3CDC7PLK4
SCHEMBL14955663 0.86 BTK (0.41) BTKLCKJAK3CDC7PLK4
SCHEMBL14955660 0.86 BTK (0.41) BTKLCKJAK3CDC7PLK4
SCHEMBL14976607 0.85 BTK (0.40) BTKLCKJAK3CDC7PLK4
SCHEMBL14955444 0.82 BTK (0.42) BTKLCKJAK3CDC7PLK4
SCHEMBL14955447 0.82 BTK (0.42) BTKLCKJAK3CDC7PLK4

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
EP-2782579-A1 PYRAZINE KINASE INHIBITORS Portola Pharmaceuticals, Inc. (US) 2014-10-01 — — EP disclosed
WO-2013078466-A1 PYRAZINE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 — — WO disclosed
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