SCHEMBL14975828

SCHEMBL14975828

Cc1cccc(Nc2nc(N[C@@H]3CCNC3)ncc2C(N)=O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 1.00
▸ KCNH2 Q12809 15/20 1.00
▸ AURKB Q96GD4 11/20 1.00
▸ MAPK3 P27361 10/20 1.00
▸ MAPK1 P28482 10/20 1.00
▸ GP6 Q9HCN6 1/20 0.67

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
SCHEMBL14975829 1.00 SYK (1.00) SYKKCNH2AURKBMAPK3MAPK1
SCHEMBL14976634 0.86 SYK (0.76) SYKKCNH2AURKBMAPK3MAPK1
SCHEMBL14976632 0.86 SYK (0.76) SYKKCNH2AURKBMAPK3MAPK1
SCHEMBL2627337 0.85 SYK (0.77) SYKKCNH2AURKBMAPK3MAPK1
SCHEMBL1355277 0.85 SYK (0.77) SYKKCNH2AURKBMAPK3MAPK1
SCHEMBL1355278 0.85 SYK (0.77) SYKKCNH2AURKBMAPK3MAPK1
SCHEMBL14977673 0.85 SYK (0.73) SYKKCNH2AURKBMAPK3MAPK1
SCHEMBL14977786 0.85 SYK (0.73) SYKKCNH2AURKBMAPK3MAPK1
SCHEMBL16195020 0.84 SYK (0.74) SYKKCNH2AURKBMAPK3MAPK1
SCHEMBL14981584 0.84 SYK (0.74) SYKKCNH2AURKBMAPK3MAPK1

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 6 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

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 3642/4885AURKB 110/4885

“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.

Send feedback