SCHEMBL13723442

SCHEMBL13723442

NC(=O)NC1CCN(c2nc(N)ncc2F)CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAP3K5 Q99683 3/20 0.42
▸ MAP3K6 O95382 1/20 0.42
▸ PAK1 Q13153 4/20 0.40
▸ ACACB O00763 2/20 0.38
▸ PIK3CA P42336 2/20 0.37
▸ MTOR P42345 2/20 0.37
▸ PAK3 O75914 1/20 0.37
▸ PAK2 Q13177 1/20 0.37
▸ BTK Q06187 2/20 0.37
▸ HRH4 Q9H3N8 1/20 0.37
▸ ALOX5AP P20292 1/20 0.36
▸ FEN1 P39748 1/20 0.36
▸ OPRK1 P41145 2/20 0.36
▸ AOC3 Q16853 1/20 0.36

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
SCHEMBL13724547 0.83 DRD2 (0.41) MAP3K5MAP3K6PAK1ACACBPIK3CA
SCHEMBL13724195 0.81 ADORA2A (0.45) ACACBPIK3CAMTOR
SCHEMBL13724439 0.80 FFAR4 (0.37) PIK3CAMTORHRH4
SCHEMBL13723870 0.77 HRH4 (0.44) PIK3CAMTORHRH4
SCHEMBL13732517 0.76 PDE10A (0.41) ACACBPIK3CAMTORHRH4ALOX5AP
SCHEMBL13724746 0.73 EIF2AK4 (0.56) OPRK1
SCHEMBL1015930 0.73 SYK (0.60) —
SCHEMBL30567236 0.71 TDO2 (0.51) PAK1AOC3
SCHEMBL13724424 0.70 HRH3 (0.49) HRH4
SCHEMBL14541937 0.70 KDM4E (0.69) PIK3CAMTORHRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 — — US disclosed
US-20180305356-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2018-10-25 — — US disclosed
US-10000482-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2018-06-19 — — US disclosed
US-9802937-B2 Substituted pyrazolo{4,3-D}pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-10-31 — — US disclosed
US-9637491-B2 Pyrazolo[4,3-D]pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-05-02 — — US disclosed
US-9499535-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2016-11-22 — — US disclosed
EP-2699572-B1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2016-08-10 — — EP disclosed
EP-2699579-B1 PYRAZOLO[4,3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-10-07 — — EP disclosed
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-24 — — US disclosed
US-20150259340-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-17 — — US disclosed
WO-2014060112-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2014-04-24 — — WO disclosed
WO-2014060113-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2014-04-24 — — WO disclosed
EP-2699579-A1 PYRAZOLO [4, 3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 — — EP disclosed
EP-2699572-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 — — EP disclosed
US-20120329780-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 — — US disclosed
US-20120329785-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 — — US disclosed
WO-2012143144-A1 PYRAZOLO [4, 3-D] PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 — — WO disclosed
WO-2012143143-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 — — 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 (7 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-20150259340-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK MAP3K5 72/4885MAP3K6 62/4885PAK1 398/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK MAP3K5 78/4885MAP3K6 79/4885PAK1 256/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK MAP3K5 72/4885MAP3K6 62/4885PAK1 398/4885
US-20120329780-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK MAP3K5 72/4885MAP3K6 62/4885PAK1 398/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 MAP3K5 85/4885MAP3K6 58/4885PAK1 285/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK MAP3K5 63/4885MAP3K6 55/4885PAK1 348/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK MAP3K5 63/4885MAP3K6 55/4885PAK1 348/4885

“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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