SCHEMBL2126340

SCHEMBL2126340

CN1CCC(OC(N)=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 4/20 0.50
SCN2A Q99250 4/20 0.50
SCN3A Q9NY46 4/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
CHRM3 P20309 2/20 0.49
CHRM4 P08173 1/20 0.49
CHRM5 P08912 1/20 0.49
CHRM1 P11229 1/20 0.49
ATM Q13315 2/20 0.47
ALDH1A1 P00352 2/20 0.44
RAB9A P51151 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL21816700 0.89 L3MBTL3 (0.43) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL28545335 0.88 ATM (0.42) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL23931262 0.88 CHRM4 (0.51) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL27038904 0.88 CHRM4 (0.51) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL4201270 0.88 CHRM4 (0.51) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL1023344 0.82 SCN1A (0.53) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL1936279 0.81 L3MBTL3 (0.40) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL1331414 0.80 SCN1A (0.51) SCN1ASCN2ASCN3AKMT2AMEN1
SCHEMBL6954112 0.80 SCN1A (0.51) SCN1ASCN2ASCN3AKMT2AMEN1
Hydrochloric Acid SCHEMBL28532026 0.80 KMT2A (0.56) SCN1ASCN2ASCN3AKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110637015-A Farnesoin X receptor agonists and uses thereof 梅塔科林公司 2019-12-31 CN claimed
CN-100421665-C Mitotic kinesin inhibitors MERCK & CO INC (US) 2008-10-01 CN claimed
CN-1674906-A Mitotic kinesin inhibitors MERCK & CO INC (US) 2005-09-28 CN claimed
CN-116354923-B Nitrogen-containing heterocyclic compound and application thereof 江苏恩华药业股份有限公司 2025-05-09 CN disclosed
CN-119522227-A Macrocyclic compounds, pharmaceutical compositions and uses thereof 贝达药业股份有限公司 2025-02-25 CN disclosed
CN-117980327-A Specific coupling of antibodies 杭州多禧生物科技有限公司 2024-05-03 CN disclosed
CN-117897149-A 3, 4-methylenedioxymethamphetamine and related hallucinogens and uses thereof 人类生物科学股份有限公司 2024-04-16 CN disclosed
CN-114773254-B Quaternary ammonium salt compound or salt thereof and application thereof, and method for distinguishing 2-hydroxyl-substituted fatty acid from 3-hydroxyl-substituted fatty acid 中国科学院上海药物研究所 2024-02-13 CN disclosed
WO-2024017358-A1 MACROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 贝达药业股份有限公司 2024-01-25 WO disclosed
CN-109111385-B 5-HT 2A Receptor inhibitor and preparation method and application thereof 上海翰森生物医药科技有限公司 2023-06-30 CN disclosed
CN-116354923-A Nitrogen-containing heterocyclic compound and application thereof 江苏恩华药业股份有限公司 2023-06-30 CN disclosed
US-8461163-B2 Substituted N-(pyrazolo[1,5-a]pyrimidin-5-yl)amides as inhibitors of apoptosis signal-regulating kinase 1 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-06-11 US disclosed
US-8461163-B2 Substituted N-(pyrazolo[1,5-a]pyrimidin-5-yl)amides as inhibitors of apoptosis signal-regulating kinase 1 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-06-11 US disclosed
WO-2012137982-A9 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-14 WO disclosed
WO-2012137982-A2 SULFONAMIDE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-11 WO disclosed
EP-2443104-A1 DISUBSTITUTED PHTHALAZINE HEDGEHOG PATHWAY ANTAGONISTS Eli Lilly and Company (US) 2012-04-25 EP disclosed
US-20110077235-A1 APOPTOSIS SIGNAL-REGULATING KINASE 1 INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-31 US disclosed
WO-2010147917-A1 DISUBSTITUTED PHTHALAZINE HEDGEHOG PATHWAY ANTAGONISTS ELI LILLY AND COMPANY (US) 2010-12-23 WO disclosed
CN-100421665-C Mitotic kinesin inhibitors MERCK & CO INC (US) 2008-10-01 CN disclosed
CN-1674906-A Mitotic kinesin inhibitors MERCK & CO INC (US) 2005-09-28 CN 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 (1 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-20110077235-A1 APOPTOSIS SIGNAL-REGULATING KINASE 1 INHIBITORS BAX, BCL2, BAD SCN1A 3413/4885SCN2A 4497/4885SCN3A 4601/4885

“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.