SCHEMBL2714790

SCHEMBL2714790

O=C(O)c1ccnc(NC(=O)C2CC2)n1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.61
▸ KDM5A P29375 1/20 0.61
▸ JMJD1C Q15652 1/20 0.61
▸ KDM3A Q9Y4C1 1/20 0.61
▸ ADORA1 P30542 5/20 0.49
▸ ADORA2A P29274 4/20 0.49
▸ ADORA3 P0DMS8 2/20 0.49
▸ HPGD P15428 1/20 0.47
▸ ACVRL1 P37023 2/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ GSK3B P49841 5/20 0.46
▸ LMNA P02545 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ ABL1 P00519 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ ADORA2B P29275 1/20 0.43
▸ JAK1 P23458 1/20 0.42

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
SCHEMBL22186405 0.94 KDM4E (0.58) KDM4EKDM5AJMJD1CKDM3AADORA1
SCHEMBL30449743 0.89 GSK3B (0.56) KDM4EKDM5AJMJD1CKDM3AADORA1
SCHEMBL4550418 0.85 ADORA1 (0.45) KDM4EKDM5AJMJD1CKDM3AADORA1
SCHEMBL18266119 0.85 KDM4E (0.58) KDM4EKDM5AJMJD1CKDM3AADORA1
SCHEMBL2715477 0.84 JAK1 (0.47) KDM4EADORA1ADORA2AADORA3HPGD
SCHEMBL18266721 0.82 KDM4E (0.59) KDM4EKDM5AJMJD1CKDM3AHPGD
SCHEMBL29155745 0.79 POLB (0.64) KDM4EADORA1ADORA2AADORA3HPGD
SCHEMBL22809469 0.77 HPGD (0.46) ADORA1ADORA2AADORA3HPGDACVRL1
SCHEMBL22186826 0.77 KDM4E (0.69) KDM4EKDM5AJMJD1CKDM3AADORA1
SCHEMBL18943862 0.76 KDM4E (1.00) KDM4EKDM5AJMJD1CKDM3AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12110287-B2 Heterocyclic derivatives as Nav1.7 and Nav1.8 blockers RAQUALIA PHARMA INC. (JP) 2024-10-08 — — US disclosed
CN-110612285-B Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2023-04-04 — — CN disclosed
US-20220048892-A1 HETEROCYCLIC DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RAQUALIA PHARMA INC. (JP) 2022-02-17 — — US disclosed
EP-3902544-A1 HETEROCYCLIC DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RaQualia Pharma Inc. (JP) 2021-11-03 — — EP disclosed
US-11154544-B2 Amide derivatives as Nav1.7 and Nav1.8 blockers RAQUALIA PHARMA INC. (JP) 2021-10-26 — — US disclosed
US-11154544-B2 Amide derivatives as Nav1.7 and Nav1.8 blockers RAQUALIA PHARMA INC. (JP) 2021-10-26 — — US disclosed
CN-113164461-A Heterocyclic derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2021-07-23 — — CN disclosed
EP-3487839-B1 AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RAQUALIA PHARMA INC (JP) 2020-12-23 — — EP disclosed
EP-3487839-B1 AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RAQUALIA PHARMA INC (JP) 2020-12-23 — — EP disclosed
WO-2020138271-A1 HETEROCYCLIC DERIVATIVES AS Nav1.7 and Nav1.8 BLOCKERS RAQUALIA PHARMA INC. (JP) 2020-07-02 — — WO disclosed
CN-110612285-A Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2019-12-24 — — CN disclosed
EP-3487839-A1 AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RaQualia Pharma Inc. (JP) 2019-05-29 — — EP disclosed
WO-2018235851-A1 AMIDE DERIVATIVES AS Nav1.7 and Nav1.8 BLOCKERS RAQUALIA PHARMA INC. (JP) 2018-12-27 — — WO disclosed
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 — — EP disclosed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 — — US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 — — US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 — — US disclosed
EP-2630122-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RaQualia Pharma Inc (JP) 2013-08-28 — — EP disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 — — WO disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 — — 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 (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-12110287-B2 Heterocyclic derivatives as Nav1.7 and Nav1.8 blockers SCN8A, SCN7A, SCN1A KDM4E 2761/4885KDM5A 2400/4885JMJD1C 2651/4885
US-11154544-B2 Amide derivatives as Nav1.7 and Nav1.8 blockers SCN8A, SCN7A, SCN1A KDM4E 1418/4885KDM5A 1294/4885JMJD1C 2444/4885
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS SCN2B, SCN1B, SCN2A KDM4E 1168/4885KDM5A 711/4885JMJD1C 3249/4885
US-20220048892-A1 HETEROCYCLIC DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS SCN8A, SCN7A, SCN1A KDM4E 2761/4885KDM5A 2400/4885JMJD1C 2651/4885

“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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