SCHEMBL14955587

SCHEMBL14955587

NC(=O)c1ncc(N[C@@H]2CCCC[C@@H]2N)nc1Nc1cccnc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 4/20 0.73
▸ CHEK2 O96017 2/20 0.73
▸ JAK2 O60674 2/20 0.73
▸ ROCK2 O75116 2/20 0.73
▸ MAP4K4 O95819 2/20 0.73
▸ HCK P08631 2/20 0.73
▸ ROS1 P08922 2/20 0.73
▸ PIM1 P11309 2/20 0.73
▸ FER P16591 2/20 0.73
▸ PRKACA P17612 2/20 0.73
▸ MARK3 P27448 2/20 0.73
▸ LTK P29376 2/20 0.73
▸ CSNK1A1 P48729 2/20 0.73
▸ CLK2 P49760 2/20 0.73
▸ MAPK10 P53779 2/20 0.73
▸ MAP2K1 Q02750 2/20 0.73
▸ MAP3K10 Q02779 2/20 0.73
▸ PRKCQ Q04759 2/20 0.73
▸ PTK2 Q05397 2/20 0.73
▸ TYRO3 Q06418 2/20 0.73

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
SCHEMBL14955695 0.88 LRRK2 (0.69) LRRK2CHEK2JAK2ROCK2MAP4K4
SCHEMBL14955934 0.87 LRRK2 (0.68) LRRK2CHEK2JAK2ROCK2MAP4K4
SCHEMBL14956044 0.85 IRAK4 (0.54) LRRK2CHEK2JAK2ROCK2MAP4K4
SCHEMBL5027864 0.85 SYK (0.71) LRRK2CHEK2JAK2ROCK2MAP4K4
SCHEMBL14956519 0.85 LRRK2 (0.71) LRRK2CHEK2JAK2ROCK2MAP4K4
SCHEMBL6158561 0.84 FER (1.00) LRRK2CHEK2JAK2ROCK2MAP4K4
SCHEMBL6158559 0.84 FER (1.00) LRRK2CHEK2JAK2ROCK2MAP4K4
SCHEMBL14955619 0.84 LRRK2 (0.67) LRRK2CHEK2JAK2ROCK2MAP4K4
SCHEMBL16743226 0.84 SYK (0.70) JAK2ROS1PAK4IRAK1SLK
SCHEMBL14955390 0.84 LRRK2 (0.65) LRRK2CHEK2JAK2ROCK2MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9359308-B2 Pyrazine kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2016-06-07 — — US disclosed
US-9359308-B2 Pyrazine kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2016-06-07 — — US disclosed
US-9359308-B2 Pyrazine kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2016-06-07 — — US disclosed
US-8877760-B2 Substituted pyrazine-2-carboxamide kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2014-11-04 — — US disclosed
US-8877760-B2 Substituted pyrazine-2-carboxamide kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2014-11-04 — — US disclosed
US-8877760-B2 Substituted pyrazine-2-carboxamide kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2014-11-04 — — US disclosed
US-20140309209-A1 Pyrazine Kinase Inhibitors ALEXION PHARMACEUTICALS, INC. 2014-10-16 — — US disclosed
US-20140309209-A1 Pyrazine Kinase Inhibitors ALEXION PHARMACEUTICALS, INC. 2014-10-16 — — US disclosed
US-20140309209-A1 Pyrazine Kinase Inhibitors ALEXION PHARMACEUTICALS, INC. 2014-10-16 — — US disclosed
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
US-20130131040-A1 PYRAZINE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-23 — — US disclosed
US-20130131040-A1 PYRAZINE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-23 — — US disclosed
US-20130131040-A1 PYRAZINE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-23 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130131040-A1 PYRAZINE KINASE INHIBITORS SYK, ZAP70, LCK LRRK2 800/4885CHEK2 197/4885JAK2 29/4885
US-20140309209-A1 Pyrazine Kinase Inhibitors SYK, ZAP70, LCK LRRK2 800/4885CHEK2 197/4885JAK2 29/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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