SCHEMBL13724201

SCHEMBL13724201

CS(=O)(=O)c1ccccc1-c1cccc(N)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.48
FEN1 P39748 2/20 0.48
MAOA P21397 2/20 0.47
BRD4 O60885 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
MAP4K4 O95819 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 2/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.42
PTGS2 P35354 1/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
USP28 Q96RU2 1/20 0.40
ATR Q13535 1/20 0.40
LOX P28300 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL4926176 0.86 MAOA (0.50) ALOX5APFEN1MAOABRD4CA12
SCHEMBL6613230 0.84 CA1 (0.54) ALOX5APFEN1MAOABRD4CA12
SCHEMBL31213502 0.83 ALDH1A1 (0.50) ALOX5APFEN1MAOABRD4CA12
SCHEMBL3830209 0.80 PTGS2 (0.48) ALOX5APFEN1CA12CA1CA2
SCHEMBL5495714 0.80 ALOX5AP (0.56) ALOX5APFEN1
SCHEMBL4433420 0.79 ALOX5AP (0.51) ALOX5APFEN1RAB9AKMT2AMAPT
SCHEMBL3836209 0.79 ALOX5AP (0.48) ALOX5APFEN1RAB9AKMT2APTGS2
SCHEMBL5734224 0.79 RAB9A (0.64) ALOX5APFEN1RAB9AKMT2APTGS2
SCHEMBL29415408 0.79 PTGS2 (0.61) MAOAL3MBTL1RAB9AKMT2APTGS2
SCHEMBL937206 0.79 PTGS2 (0.61) MAOAL3MBTL1RAB9AKMT2APTGS2

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
EP-2699572-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 EP 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
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 ALOX5AP 3340/4885FEN1 4220/4885MAOA 1330/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK ALOX5AP 2922/4885FEN1 3250/4885MAOA 1163/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK ALOX5AP 3340/4885FEN1 4220/4885MAOA 1330/4885
US-20120329780-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK ALOX5AP 3340/4885FEN1 4220/4885MAOA 1330/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 ALOX5AP 4401/4885FEN1 3208/4885MAOA 1206/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK ALOX5AP 3161/4885FEN1 4178/4885MAOA 1176/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK ALOX5AP 3161/4885FEN1 4178/4885MAOA 1176/4885

“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.