SCHEMBL14975888

SCHEMBL14975888

NC(=O)c1cnc(NC2CCCNC2)nc1Nc1cnc2ccccc2c1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 11/20 0.71
▸ KCNH2 Q12809 6/20 0.71
▸ MAPK3 P27361 4/20 0.71
▸ MAPK1 P28482 3/20 0.71
▸ AURKB Q96GD4 3/20 0.71
▸ CHEK1 O14757 6/20 0.59
▸ MAPK8 P45983 1/20 0.54
▸ MAPK9 P45984 1/20 0.54
▸ PDPK1 O15530 1/20 0.48
▸ RPS6KB1 P23443 1/20 0.48

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
SCHEMBL14975884 1.00 SYK (0.71) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL14975494 0.84 SYK (0.70) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL14975493 0.84 SYK (0.70) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL14955850 0.82 CHEK1 (0.53) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL14955848 0.82 CHEK1 (0.53) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL30261007 0.82 ULK1 (0.65) CHEK1
SCHEMBL14976992 0.81 MAPK8 (0.53) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL14976362 0.81 SYK (0.55) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL14981788 0.78 SYK (0.71) SYKKCNH2MAPK3MAPK1AURKB
SCHEMBL14975828 0.77 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 3 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
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

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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