SCHEMBL13723802

SCHEMBL13723802

Cc1cc(N)ccc1C1CCN(C2CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
ZAP70 P43403 1/20 0.39
ALDH1A1 P00352 4/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
THRB P10828 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 2/20 0.39
NR4A1 P22736 1/20 0.39
PTK2B Q14289 1/20 0.39
SLC18A3 Q16572 2/20 0.36
CYP3A4 P08684 1/20 0.35
PDE10A Q9Y233 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RAD52 P43351 1/20 0.35
GFER P55789 1/20 0.35

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
SCHEMBL10127647 0.91 HTR1D (0.52) HTR1DHTR1BZAP70ALDH1A1MAPT
SCHEMBL522141 0.83 HTR1D (0.56) HTR1DHTR1BALDH1A1MAPTMEN1
SCHEMBL23334746 0.82 ALDH1A1 (0.50) HTR1DHTR1BALDH1A1MAPTMEN1
SCHEMBL12070784 0.79 GAA (0.54) HTR1DHTR1BALDH1A1MAPTMEN1
SCHEMBL13724208 0.79 SOS1 (0.42) HTR1DHTR1BALDH1A1MAPTMEN1
SCHEMBL13728741 0.79 HTR1D (0.40) HTR1DHTR1BALDH1A1MAPTMEN1
SCHEMBL22640335 0.79 ALDH1A1 (0.46) HTR1DHTR1BALDH1A1MAPTMEN1
SCHEMBL10127744 0.79 HTR1D (0.52) HTR1DHTR1BALDH1A1GAACYP3A4
SCHEMBL13548515 0.79 CYP3A4 (0.38) HTR1DHTR1BZAP70ALDH1A1SLC18A3
SCHEMBL17630843 0.78 HTR1D (0.39) HTR1DHTR1BALDH1A1MAPTMEN1

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 19 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
CN-103492389-A Pyrazolo [4, 3-d] pyrimidines useful as kinase inhibitors ORIGENIS GMBH 2014-01-01 CN 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-2012143143-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 WO disclosed
WO-2012143144-A1 PYRAZOLO [4, 3-D] PYRIMIDINES USEFUL 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 HTR1D 2159/4885HTR1B 2000/4885ZAP70 211/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK HTR1D 1213/4885HTR1B 1664/4885ZAP70 188/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK HTR1D 2159/4885HTR1B 2000/4885ZAP70 211/4885
US-20120329780-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK HTR1D 2159/4885HTR1B 2000/4885ZAP70 211/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 HTR1D 3432/4885HTR1B 2536/4885ZAP70 147/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK HTR1D 2001/4885HTR1B 1759/4885ZAP70 170/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK HTR1D 2001/4885HTR1B 1759/4885ZAP70 170/4885

“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.