SCHEMBL1703399

SCHEMBL1703399

Nc1cnn([C@@H]2CCOC2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 4/20 0.40
▸ JAK2 O60674 2/20 0.40
▸ NAMPT P43490 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39
▸ KIT P10721 1/20 0.38
▸ KDM5A P29375 1/20 0.38
▸ ROCK1 Q13464 1/20 0.37
▸ HCRTR1 O43613 1/20 0.36
▸ HCRTR2 O43614 1/20 0.36
▸ JAK1 P23458 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ MET P08581 2/20 0.35
▸ IRAK4 Q9NWZ3 2/20 0.34
▸ MPO P05164 1/20 0.34
▸ NTRK1 P04629 1/20 0.34
▸ BMPR1A P36894 1/20 0.33
▸ ACVRL1 P37023 1/20 0.33
▸ ACVR1 Q04771 1/20 0.33
▸ IDO1 P14902 1/20 0.33

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
SCHEMBL1703270 1.00 LRRK2 (0.40) LRRK2JAK2NAMPTMKNK1MKNK2
SCHEMBL12598741 1.00 LRRK2 (0.40) LRRK2JAK2NAMPTMKNK1MKNK2
SCHEMBL15652587 0.90 BMPR1A (0.37) LRRK2JAK2NAMPTMKNK1MKNK2
SCHEMBL1422774 0.89 MET (0.41) LRRK2JAK2MKNK1KDM5AJAK1
Hydrochloric Acid SCHEMBL16593449 0.88 MET (0.42) LRRK2JAK2MKNK1KDM5AJAK1
Hydrochloric Acid SCHEMBL15875304 0.88 MET (0.42) LRRK2JAK2MKNK1KDM5AJAK1
SCHEMBL2574462 0.85 KIT (0.48) LRRK2JAK2MKNK1MKNK2KIT
SCHEMBL28484611 0.85 KDM5A (0.34) LRRK2JAK2KITKDM5AMET
SCHEMBL10191777 0.81 IRAK4 (0.38) LRRK2JAK2MKNK1KDM5AJAK1
SCHEMBL25249934 0.79 LRRK2 (0.40) LRRK2JAK2NAMPTMKNK1MKNK2

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-20250304567-A1 PYRROLIDIONE DERIVATIVES AS INHIBITORS OF NF KAPPA B INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2025-10-02 — — US disclosed
CN-115023428-B Pyrimidopyrroles compounds 江苏先声药业有限公司 2025-04-08 — — CN disclosed
CN-115244055-B Pyrimidine five-membered ring derivative and application thereof 江苏先声药业有限公司 2024-09-03 — — CN disclosed
CN-115244055-A Pyrimido five-membered ring derivative and application thereof 江苏先声药业有限公司 2022-10-25 — — CN disclosed
CN-115023428-A Pyrimidopyrroles 江苏先声药业有限公司 2022-09-06 — — CN disclosed
US-9701680-B2 Pyrimidine and pyridine compounds and their usage HUTCHISON MEDIPHARMA LIMITED (CN) 2017-07-11 — — US disclosed
US-9701680-B2 Pyrimidine and pyridine compounds and their usage HUTCHISON MEDIPHARMA LIMITED (CN) 2017-07-11 — — US disclosed
US-20160052926-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND USAGE THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2016-02-25 — — US disclosed
US-20160052926-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND USAGE THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2016-02-25 — — US disclosed
US-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE HUTCHISON MEDIPHARMA LIMITED (CN) 2016-01-28 — — US disclosed
US-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE HUTCHISON MEDIPHARMA LIMITED (CN) 2016-01-28 — — US disclosed
WO-2015123722-A1 INHIBITORS BIONOMICS LIMITED (AU) 2015-08-27 — — WO disclosed
WO-2014139145-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND USAGE THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2014-09-18 — — WO disclosed
WO-2014139465-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE HUTCHISON MEDIPHARMA LIMITED (CN) 2014-09-18 — — WO disclosed
US-8426408-B2 Pyrimidine inhibitors of kinases ABBVIE INC. (US) 2013-04-23 — — US disclosed
EP-2440548-A1 2- ( LH-PYRAZOL-4 -YLAMINO ) -PYRIMIDINE AS KINASE INHIBITORS Abbott Laboratories (US) 2012-04-18 — — EP disclosed
US-20100317680-A1 PYRIMIDINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2010-12-16 — — US disclosed
WO-2010144468-A1 2- ( LH-PYRAZOL-4 -YLAMINO ) -PYRIMIDINE AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2010-12-16 — — 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 (4 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-20100317680-A1 PYRIMIDINE INHIBITORS OF KINASES AURKA, AURKC, AURKB LRRK2 1841/4885JAK2 256/4885NAMPT 909/4885
US-20250304567-A1 PYRROLIDIONE DERIVATIVES AS INHIBITORS OF NF KAPPA B INDUCING KINASE NFKBIA, IKBKG, IKBKB LRRK2 551/4885JAK2 517/4885NAMPT 1753/4885
US-20160052926-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND USAGE THEREOF FGFR3, FGFR1, FGFR4 LRRK2 236/4885JAK2 11/4885NAMPT 574/4885
US-20160024021-A1 NOVEL PYRIMIDINE AND PYRIDINE COMPOUNDS AND THEIR USAGE FGFR3, FGFR1, FGFR4 LRRK2 219/4885JAK2 12/4885NAMPT 614/4885

“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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