SCHEMBL4697737

SCHEMBL4697737

C1CCCC(C2(C3CCCC3)CCCCC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.41
SCN4A P35499 1/20 0.41
SCN7A Q01118 1/20 0.41
KCNH2 Q12809 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41
SCN11A Q9UI33 1/20 0.41
SCN8A Q9UQD0 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.41
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
HSD17B10 Q99714 1/20 0.30
GRIN1 Q05586 2/20 0.30
GRIN2A Q12879 2/20 0.30

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
SCHEMBL4655278 1.00 SCN1A (0.41) SCN1ASCN4ASCN7AKCNH2SCN5A
SCHEMBL30492082 1.00 SCN1A (0.41) SCN1ASCN4ASCN7AKCNH2SCN5A
SCHEMBL1630078 1.00 SCN1A (0.41) SCN1ASCN4ASCN7AKCNH2SCN5A
SCHEMBL181178 1.00 SCN1A (0.41) SCN1ASCN4ASCN7AKCNH2SCN5A
SCHEMBL2993610 1.00 SCN1A (0.41) SCN1ASCN4ASCN7AKCNH2SCN5A
SCHEMBL8529811 1.00 SCN1A (0.41) SCN1ASCN4ASCN7AKCNH2SCN5A
SCHEMBL6079568 0.97 SCN1A (0.39) SCN1ASCN4ASCN7AKCNH2SCN5A
SCHEMBL4748922 0.97 SCN1A (0.39) SCN1ASCN4ASCN7AKCNH2SCN5A
SCHEMBL4012058 0.97 SCN1A (0.39) SCN1ASCN4ASCN7AKCNH2SCN5A
SCHEMBL1814570 0.97 SCN1A (0.42) SCN1ASCN4ASCN7AKCNH2SCN5A

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1560823-B1 4-SUBSTITUTED 1-AMINOCYCLOHEXANE DERIVATIVES FOR UTILIZATION AS ORL1-RECEPTOR AND MU-OPIATE RECEPTOR LIGANDS GRUENENTHAL GMBH (DE) 2008-07-09 EP claimed
EP-4196267-B1 NOVEL RUTHENIUM COMPLEXES, METHODS OF THEIR PREPARATION AND APPLICATION THEREOF IN OLEFIN CROSS METATHESIS APEIRON SYNTHESIS SA (PL) 2023-11-29 EP disclosed
US-10233149-B2 Methods for forming peroxyformic acid and uses thereof ECOLAB USA INC. (US) 2019-03-19 US disclosed
US-20180093948-A1 METHODS FOR FORMING PEROXYFORMIC ACID AND USES THEREOF ECOLAB USA INC. 2018-04-05 US disclosed
EP-1487829-B1 THIADIAZOLYLPIPERAZINE DERIVATIVES USEFUL FOR TREATING OR PREVENTING PAIN EURO CELTIQUE SA (LU) 2007-10-10 EP disclosed
EP-0970084-B1 PYRROLO 2,3D]PYRIMIDINES AND THEIR USE AS TYROSINE KINASE INHIBITORS BASF AG (DE) 2003-06-04 EP disclosed
EP-0970084-A1 PYRROLO 2,3D]PYRIMIDINES AND THEIR USE AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2000-01-12 EP disclosed
US-6001839-A Substituted 4-amino-7H-pyrrolo [2,3,-d]-pyrimidines as PTK inhibitors BASF AKTIENGESELLSCHAFT (DE) 1999-12-14 US disclosed
WO-1998041525-A1 PYRROLO[2,3D]PYRIMIDINES AND THEIR USE AS TYROSINE KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 1998-09-24 WO disclosed
EP-0361341-A2 Therapeutics for aids based on inhibitors of HIV protease MILES INC. (US) 1990-04-04 EP 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 (2 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-10233149-B2 Methods for forming peroxyformic acid and uses thereof PRDX2, PRDX6, PRDX1 SCN1A 4174/4885SCN4A 4302/4885SCN7A 3006/4885
US-20180093948-A1 METHODS FOR FORMING PEROXYFORMIC ACID AND USES THEREOF PRDX2, PRDX6, PRDX1 SCN1A 4174/4885SCN4A 4302/4885SCN7A 3006/4885

“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.