SCHEMBL14977673

SCHEMBL14977673

NC(=O)c1cnc(N[C@@H]2CCNC2)nc1Nc1cccc(-n2nccn2)c1

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 0.73
▸ KCNH2 Q12809 6/20 0.73
▸ MAPK3 P27361 3/20 0.73
▸ MAPK1 P28482 3/20 0.73
▸ AURKB Q96GD4 3/20 0.73
▸ JAK2 O60674 1/20 0.69
▸ LCK P06239 1/20 0.69
▸ YES1 P07947 1/20 0.69
▸ LYN P07948 1/20 0.69
▸ FGR P09769 1/20 0.69
▸ SRC P12931 1/20 0.69
▸ PRKCA P17252 1/20 0.69
▸ FLT3 P36888 1/20 0.69
▸ ZAP70 P43403 1/20 0.69
▸ MAP3K9 P80192 1/20 0.69
▸ PAK5 Q9P286 1/20 0.69

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
SCHEMBL14977786 1.00 SYK (0.73) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL13624681 0.88 SYK (0.82) SYKKCNH2JAK2LCKYES1
SCHEMBL14977720 0.87 SYK (0.71) SYKKCNH2JAK2LCKYES1
SCHEMBL14977719 0.87 SYK (0.71) SYKKCNH2JAK2LCKYES1
SCHEMBL1351989 0.87 SYK (0.81) SYKKCNH2JAK2LCKYES1
SCHEMBL2627305 0.87 SYK (0.81) SYKKCNH2JAK2LCKYES1
SCHEMBL1351992 0.87 SYK (0.81) SYKKCNH2JAK2LCKYES1
SCHEMBL14977506 0.86 SYK (0.70) SYKKCNH2JAK2LCKYES1
SCHEMBL14977505 0.86 SYK (0.70) SYKKCNH2JAK2LCKYES1
SCHEMBL14975829 0.85 SYK (1.00) SYKKCNH2MAPK3MAPK1AURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140323418-A1 SELECTIVE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-30 — — US disclosed
US-20140323418-A1 SELECTIVE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-30 — — US disclosed
US-20140323418-A1 SELECTIVE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-30 — — US disclosed
EP-2782580-A1 SELECTIVE KINASE INHIBITORS Portola Pharmaceuticals, Inc. (US) 2014-10-01 — — EP disclosed
WO-2013078468-A1 SELECTIVE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 — — WO disclosed
WO-2013078468-A1 SELECTIVE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 — — WO disclosed
WO-2013078254-A1 BICYCLIC HETEROARYL DERIVATIVES AS KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2013-05-30 — — WO 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 (1 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-20140323418-A1 SELECTIVE KINASE INHIBITORS SYK, BTK, LCK SYK 1/4885KCNH2 3642/4885MAPK3 449/4885

“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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