SCHEMBL254989

SCHEMBL254989

CN1CCOCCOCCOCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
CA12 O43570 2/20 0.43
TTR P02766 1/20 0.43
CA7 P43166 1/20 0.43
CA14 Q9ULX7 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MGLL Q99685 1/20 0.40
TSHR P16473 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KEAP1 Q14145 1/20 0.36
LMNA P02545 1/20 0.36
CYP2A13 Q16696 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HPGD P15428 1/20 0.35
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL15384649 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA12TTRCA7CA14
SCHEMBL6033426 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA12TTRCA7CA14
SCHEMBL11337084 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA12TTRCA7CA14
Dioxane SCHEMBL1260650 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA12TTRCA7CA14
SCHEMBL24525605 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA12TTRCA7CA14
SCHEMBL25148134 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA12TTRCA7CA14
SCHEMBL2452972 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA12TTRCA7CA14
SCHEMBL12014324 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA12TTRCA7CA14
SCHEMBL21534078 1.00 SMN1; SMN2 (0.43) SMN1; SMN2CA12TTRCA7CA14
SCHEMBL2123718 0.96 CA12 (0.45) SMN1; SMN2CA12TTRCA7CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3939968-A1 NOVEL COMPOUND HAVING ANTICANCER ACTIVITY, AND METHOD FOR PRODUCING SAME Medicinal Bioconvergence Research Center (KR) 2022-01-19 EP disclosed
WO-2021026492-A1 KAPPA OPIOID RECEPTOR PEPTIDE AMIDE AGONISTS Humanwell Pharmaceutical US (US) 2021-02-11 WO disclosed
US-20210040150-A1 KAPPA OPIOID RECEPTOR PEPTIDE AMIDE AGONISTS YICHANG HUMANWELL PHARMACEUTICALS CO., LTD. (CN) 2021-02-11 US disclosed
EP-3721943-A1 LIPIDS, LIPID COMPOSITIONS AND METHODS OF USING THEM Novartis AG (CH) 2020-10-14 EP disclosed
US-20190345154-A1 NOVEL PYRIMIDINE DERIVATIVE HAVING ANTIMALARIAL ACTIVITY CARNA BIOSCIENCES, INC. (JP) 2019-11-14 US disclosed
EP-3542789-A2 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN-CODING RNA GlaxoSmithKline Biologicals SA (BE) 2019-09-25 EP disclosed
EP-3533795-A1 NOVEL PYRIMIDINE DERIVATIVE HAVING ANTIMALARIAL ACTIVITY Carna Biosciences Inc. (JP) 2019-09-04 EP disclosed
EP-2611420-B1 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN-CODING RNA GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2019-03-27 EP disclosed
US-9301923-B2 Lipids, lipid compositions, and methods of using them NOVARTIS AG (CH) 2016-04-05 US disclosed
US-9301923-B2 Lipids, lipid compositions, and methods of using them NOVARTIS AG (CH) 2016-04-05 US disclosed
US-20140309277-A1 LIPIDS, LIPID COMPOSITIONS, AND METHODS OF USING THEM NOVARTIS AG (CH) 2014-10-16 US disclosed
US-20140309277-A1 LIPIDS, LIPID COMPOSITIONS, AND METHODS OF USING THEM NOVARTIS AG (CH) 2014-10-16 US disclosed
US-20130189351-A1 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN CODING RNA NOVARTIS AG (CH) 2013-07-25 US disclosed
US-20130189351-A1 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN CODING RNA NOVARTIS AG (CH) 2013-07-25 US disclosed
WO-2012031046-A2 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN-CODING RNA NOVARTIS AG (CH) 2012-03-08 WO disclosed
US-20110200582-A1 LIPIDS, LIPID COMPOSITIONS, AND METHODS OF USING THEM NOVARTIS AG (CH) 2011-08-18 US disclosed
US-20110200582-A1 LIPIDS, LIPID COMPOSITIONS, AND METHODS OF USING THEM NOVARTIS AG (CH) 2011-08-18 US disclosed
WO-2011076807-A2 LIPIDS, LIPID COMPOSITIONS, AND METHODS OF USING THEM NOVARTIS AG (CH) 2011-06-30 WO disclosed
EP-0079920-A1 NEW AZA-CROWN-ETHERS AND THEIR USE. BORREGAARD IND (NO) 1983-06-01 EP disclosed
WO-1982004253-A1 NEW AZA-CROWN-ETHERS AND THEIR USE DALE JOHANNES 1982-12-09 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 (5 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-20110200582-A1 LIPIDS, LIPID COMPOSITIONS, AND METHODS OF USING THEM SGMS1, SGMS2, LIPC SMN1; SMN2 2238/4885CA12 1111/4885TTR 1978/4885
US-20130189351-A1 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN CODING RNA NSUN3, RNMT, AGO2 SMN1; SMN2 2162/4885CA12 4218/4885TTR 2435/4885
US-20140309277-A1 LIPIDS, LIPID COMPOSITIONS, AND METHODS OF USING THEM SGMS1, SGMS2, LIPC SMN1; SMN2 2238/4885CA12 1111/4885TTR 1978/4885
US-20190345154-A1 NOVEL PYRIMIDINE DERIVATIVE HAVING ANTIMALARIAL ACTIVITY UMPS, TYMS, TYMP SMN1; SMN2 4430/4885CA12 4843/4885TTR 4143/4885
US-20210040150-A1 KAPPA OPIOID RECEPTOR PEPTIDE AMIDE AGONISTS OPRK1, OPRL1, OPRD1 SMN1; SMN2 1688/4885CA12 2194/4885TTR 3353/4885

“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.