SCHEMBL2016329

SCHEMBL2016329

CCN(CC)CC(C)OC

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.38
SCN1A P35498 1/20 0.34
SCN2A Q99250 1/20 0.34
SCN3A Q9NY46 1/20 0.34
PLA2G1B P04054 1/20 0.32
PLA2G2A P14555 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL12443108 0.87 CYP1A2 (0.34) KMT2A
SCHEMBL22838462 0.85 KMT2A (0.31) KMT2A
SCHEMBL12210634 0.85 PLA2G1B (0.32) KMT2APLA2G1BPLA2G2A
SCHEMBL20614502 0.85
SCHEMBL2456181 0.80 MAPK1 (0.36) KMT2ASCN1ASCN2ASCN3APLA2G1B
SCHEMBL18502229 0.80 SCN1A (0.35) KMT2ASCN1ASCN2ASCN3APLA2G1B
SCHEMBL25021651 0.76
SCHEMBL10407571 0.76 SCN1A (0.33) KMT2ASCN1ASCN2ASCN3APLA2G1B
SCHEMBL18507946 0.76 SCN1A (0.33) KMT2ASCN1ASCN2ASCN3APLA2G1B
SCHEMBL18507948 0.76 LMNA (0.41) KMT2ASCN1ASCN2ASCN3APLA2G1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE48165-E1 Alkenyl (perfluoroalkyl) phosphinic acids MERCK PATENT GMBH (DE) 2020-08-18 US disclosed
US-10160777-B2 Alkenyl(perfluoroalkyl)phosphinic acids MERCK PATENT GMBH (DE) 2018-12-25 US disclosed
EP-3207047-B1 ALKENYL (PERFLUOROALKYL) PHOSPHINIC ACID MERCK PATENT GMBH (DE) 2018-09-12 EP disclosed
US-20170240574-A1 ALKENYL (PERFLUOROALKYL) PHOSPHINIC ACIDS MERCK PATENT GMBH (DE) 2017-08-24 US disclosed
EP-3207047-A1 ALKENYL (PERFLUOROALKYL) PHOSPHINIC ACID Merck Patent GmbH (DE) 2017-08-23 EP disclosed
US-20160304804-A1 METHOD FOR THE PRESERVATION OF A MACHINE ELEMENT AND USE OF AN ANIONIC LIQUID MERCK PATENT GMBH (DE) 2016-10-20 US disclosed
WO-2016074757-A1 METHOD FOR THE PREPARATION OF MONO- AND BIS(PERFLUOROALKYL)FLUOROPHOSPHATE SALTS AND THEIR ACIDS MERCK PATENT GMBH (DE) 2016-05-19 WO disclosed
WO-2016058668-A1 ALKENYL (PERFLUOROALKYL) PHOSPHINIC ACID MERCK PATENT GMBH (DE) 2016-04-21 WO disclosed
US-9175021-B2 Process for the preparation of perfluoroalkylcyano- or perfluoroalkylcyanofluoroborates MERCK PATENT GMBH (DE) 2015-11-03 US disclosed
US-20150291515-A1 SALTS CONTAINING TRIHYDROPERFLUOROALKOXYBUTANESULFONATE OR TRIHYDROPERFLUOROALKOXYPROPANESULFONATE ANION MERCK PATENT GMBH (DE) 2015-10-15 US disclosed
US-4388238-A FROM PRIMARY AMINES, ALCOHOLS, AND CARBONYL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1983-06-14 US disclosed
EP-0027952-B1 PROCESS FOR PREPARING N,O-DISUBSTITUTED URETHANES BAYER AG (DE) 1983-04-13 EP disclosed
EP-0027953-B1 PROCESS FOR PREPARING N,O-DISUBSTITUTED URETHANES BAYER AG (DE) 1983-02-16 EP disclosed
EP-0060476-A2 Process for the preparation of N substituted di and/or polyurethanes BAYER AG (DE) 1982-09-22 EP disclosed
EP-0059400-A2 Process for the preparation of urethanes BAYER AG (DE) 1982-09-08 EP disclosed
EP-0028331-A1 Process for preparing urethanes BAYER AG (DE) 1981-05-13 EP disclosed
EP-0027952-A1 Process for preparing N,O-disubstituted urethanes BAYER AG (DE) 1981-05-06 EP disclosed
EP-0027940-A1 Process for preparing urethanes BAYER AG (DE) 1981-05-06 EP disclosed
EP-0027953-A1 Process for preparing N,O-disubstituted urethanes BAYER AG (DE) 1981-05-06 EP disclosed
US-4098855-A METHOD OF MOLDING FOAMED POLYURETHANE ARTICLES FRIES BERND 1978-07-04 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-10160777-B2 Alkenyl(perfluoroalkyl)phosphinic acids PHOSPHO1, PFAS, SLCO4C1 KMT2A 3252/4885SCN1A 3090/4885SCN2A 3464/4885
US-20150291515-A1 SALTS CONTAINING TRIHYDROPERFLUOROALKOXYBUTANESULFONATE OR TRIHYDROPERFLUOROALKOXYPROPANESULFONATE ANION STS, ARSA, TST KMT2A 3866/4885SCN1A 1974/4885SCN2A 2559/4885
US-20170240574-A1 ALKENYL (PERFLUOROALKYL) PHOSPHINIC ACIDS PHOSPHO1, PFAS, SLCO4C1 KMT2A 3252/4885SCN1A 3090/4885SCN2A 3464/4885

“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.