SCHEMBL4724490

SCHEMBL4724490

CCOc1ncccc1C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.58
NPC1 O15118 2/20 0.56
TSHR P16473 1/20 0.56
RAB9A P51151 1/20 0.55
ALDH1A1 P00352 5/20 0.55
HPGD P15428 3/20 0.55
MAPK1 P28482 1/20 0.55
KDM4E B2RXH2 1/20 0.53
HSD17B10 Q99714 1/20 0.53
LMNA P02545 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
POLB P06746 1/20 0.52
GAA P10253 1/20 0.52

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
Nitric Acid SCHEMBL28953171 0.91 L3MBTL1 (0.56) L3MBTL1NPC1TSHRRAB9AALDH1A1
SCHEMBL3729269 0.88 ALDH1A1 (0.55) L3MBTL1NPC1TSHRRAB9AALDH1A1
SCHEMBL29786652 0.88 ALDH1A1 (0.55) L3MBTL1NPC1TSHRRAB9AALDH1A1
SCHEMBL11546391 0.86 L3MBTL1 (0.60) L3MBTL1NPC1TSHRALDH1A1HPGD
SCHEMBL23201615 0.86 L3MBTL1 (0.52) L3MBTL1NPC1TSHRRAB9AALDH1A1
SCHEMBL1681179 0.85 LMNA (0.61) L3MBTL1NPC1TSHRRAB9AALDH1A1
SCHEMBL12113209 0.84 NPC1 (0.61) L3MBTL1NPC1TSHRALDH1A1HPGD
SCHEMBL123523 0.84 L3MBTL1 (0.64) L3MBTL1NPC1TSHRALDH1A1HPGD
SCHEMBL19151006 0.84 LMNA (0.64) L3MBTL1NPC1TSHRRAB9AALDH1A1
SCHEMBL19149220 0.84 LMNA (0.64) L3MBTL1NPC1TSHRRAB9AALDH1A1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022117016-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳微芯生物科技股份有限公司 2022-06-09 WO claimed
EP-3600312-A1 PIPERIDINYL- AND PIPERAZINYL-SUBSTITUTED HETEROAROMATIC CARBOXAMIDES AS MODULATORS OF GPR6 Takeda Pharmaceutical Company Limited (JP) 2020-02-05 EP claimed
WO-2018183145-A1 PIPERIDINYL- AND PIPERAZINYL-SUBSTITUTED HETEROAROMATIC CARBOXAMIDES AS MODULATORS OF GPR6 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-10-04 WO claimed
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP claimed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US claimed
EP-1325006-A2 HETEROCYCLIC COMPOUNDS AS LIGANDS OF THE GABA A? RECEPTOR NEUROGEN CORPORATION (US) 2003-07-09 EP claimed
WO-2002012442-A2 HETEROCYCLIC COMPOUNDS AS LIGANDS OF THE GABAA RECEPTOR NEUROGEN CORPORATION (US) 2002-02-14 WO claimed
CN-115300465-A Nicorandil freeze-dried powder injection for injection and preparation method thereof 上海旭东海普药业有限公司 2022-11-08 CN disclosed
CN-115232069-A Process for preparing nicorandil 山东达冠医药科技有限公司 2022-10-25 CN disclosed
CN-114920691-A Preparation method of N- (2-hydroxyethyl) nicotinamide and preparation method of nicorandil 海口天行健药物研究有限公司 2022-08-19 CN disclosed
WO-2022117016-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳微芯生物科技股份有限公司 2022-06-09 WO disclosed
WO-2022115301-A1 MODIFIED ISOINDOLINONES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2022-06-02 WO disclosed
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 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-1940835-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PDE4 INHIBITORS GLAXO GROUP LIMITED (GB) 2008-07-09 EP disclosed
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP disclosed
WO-2007036733-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PDE4 INHIBITORS GLAXO GROUP LIMITED (GB) 2007-04-05 WO disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 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 (3 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 L3MBTL1 457/4885NPC1 4398/4885TSHR 1137/4885
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents PYGL, GYS2, AGL L3MBTL1 2102/4885NPC1 2838/4885TSHR 1758/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK L3MBTL1 485/4885NPC1 4434/4885TSHR 1024/4885

“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.