SCHEMBL14320290

SCHEMBL14320290

CNC(=O)/C=N/c1cccc(N)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.40
▸ DDX3X O00571 2/20 0.39
▸ PARP1 P09874 2/20 0.36
▸ PARP10 Q53GL7 2/20 0.36
▸ PARP14 Q460N5 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ PBRM1 Q86U86 1/20 0.35
▸ CYP3A4 P08684 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ MITF O75030 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ F2 P00734 1/20 0.34
▸ PRSS1 P07477 1/20 0.34
▸ PRSS2 P07478 1/20 0.34
▸ PRSS3 P35030 1/20 0.34

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
SCHEMBL13724211 1.00 NOS1 (0.46) NOS1ALDH1A1DDX3XPARP1PARP10
SCHEMBL13733802 0.83 NOS1 (0.40) NOS1ALDH1A1DDX3XNPSR1KDM4E
SCHEMBL14320543 0.83 NOS1 (0.40) NOS1ALDH1A1DDX3XNPSR1KDM4E
SCHEMBL19526913 0.81 NOS1 (0.55) NOS1ALDH1A1DDX3XNPSR1PBRM1
SCHEMBL14320437 0.80 NPSR1 (0.47) NOS1ALDH1A1DDX3XNPSR1PBRM1
SCHEMBL13724064 0.80 NOS1 (0.52) NOS1ALDH1A1DDX3XNPSR1PBRM1
SCHEMBL13723903 0.80 NPSR1 (0.47) NOS1ALDH1A1DDX3XNPSR1PBRM1
SCHEMBL14320269 0.80 NOS1 (0.52) NOS1ALDH1A1DDX3XNPSR1PBRM1
SCHEMBL13723121 0.79 NOS1 (0.38) NOS1ALDH1A1DDX3XNPSR1CASP1
SCHEMBL14320298 0.79 NOS1 (0.38) NOS1ALDH1A1DDX3XNPSR1CASP1

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-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
US-20120329785-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 — — US disclosed
US-20120329780-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 — — 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 (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 NOS1 1289/4885ALDH1A1 4333/4885DDX3X 4748/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK NOS1 2068/4885ALDH1A1 3674/4885DDX3X 4275/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK NOS1 1289/4885ALDH1A1 4333/4885DDX3X 4748/4885
US-20120329780-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK NOS1 1289/4885ALDH1A1 4333/4885DDX3X 4748/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 NOS1 1989/4885ALDH1A1 4394/4885DDX3X 4523/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK NOS1 1266/4885ALDH1A1 4184/4885DDX3X 4766/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK NOS1 1266/4885ALDH1A1 4184/4885DDX3X 4766/4885

“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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