SCHEMBL254139

SCHEMBL254139

CCCOCCNC(=O)CCC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.42
CASP2 P42575 1/20 0.40
CA12 O43570 4/20 0.39
CA1 P00915 4/20 0.39
CA2 P00918 4/20 0.39
CA4 P22748 4/20 0.39
CA9 Q16790 4/20 0.39
CA14 Q9ULX7 4/20 0.39
TSHR P16473 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NAAA Q02083 1/20 0.38
CNR1 P21554 1/20 0.38
ALDH1A1 P00352 1/20 0.37
FAAH O00519 4/20 0.37
LPAR1 Q92633 2/20 0.36
LPAR2 Q9HBW0 2/20 0.36
ENPP2 Q13822 1/20 0.36
DNM1 Q05193 1/20 0.35

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
SCHEMBL254834 0.98 MEN1 (0.42) EPHX2CASP2CA12CA1CA2
SCHEMBL14471253 0.98 MEN1 (0.42) EPHX2CASP2CA12CA1CA2
SCHEMBL17276977 0.92 TSHR (0.44) CASP2CA12CA1CA2CA4
SCHEMBL15132494 0.91 EPHX2 (0.41) EPHX2CASP2CA12CA1CA2
SCHEMBL15492671 0.90 MEN1 (0.47) EPHX2CASP2CA12CA1CA2
SCHEMBL20327891 0.89 MEN1 (0.41) EPHX2CASP2CA12CA1CA2
SCHEMBL13598099 0.89 MEN1 (0.41) EPHX2CASP2CA12CA1CA2
SCHEMBL15177572 0.89 TSHR (0.49) EPHX2CASP2TSHRNAAACNR1
SCHEMBL20149314 0.89 TSHR (0.41) CASP2CA12CA1CA2CA4
SCHEMBL23267578 0.88 TSHR (0.47) EPHX2CASP2TSHRNAAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3721943-A1 LIPIDS, LIPID COMPOSITIONS AND METHODS OF USING THEM Novartis AG (CH) 2020-10-14 EP disclosed
EP-3542789-A2 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN-CODING RNA GlaxoSmithKline Biologicals SA (BE) 2019-09-25 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-8802773-B2 In vivo polynucleotide delivery conjugates having enzyme sensitive linkages Arrowhead Madison Inc. (US) 2014-08-12 US disclosed
US-20130190484-A1 In Vivo Polynucleotide Delivery Conjugates Having Enzyme Sensitive Linkages Arrowhead Madison Inc. (US) 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
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
US-7351790-B2 Peptide-based compounds GE HEALTHCARE AS (NO) 2008-04-01 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 (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-20110200582-A1 LIPIDS, LIPID COMPOSITIONS, AND METHODS OF USING THEM SGMS1, SGMS2, LIPC EPHX2 388/4885CASP2 2268/4885CA12 1111/4885
US-20130189351-A1 LIPIDS SUITABLE FOR LIPOSOMAL DELIVERY OF PROTEIN CODING RNA NSUN3, RNMT, AGO2 EPHX2 3551/4885CASP2 3559/4885CA12 4218/4885
US-20140309277-A1 LIPIDS, LIPID COMPOSITIONS, AND METHODS OF USING THEM SGMS1, SGMS2, LIPC EPHX2 388/4885CASP2 2268/4885CA12 1111/4885
US-20130190484-A1 In Vivo Polynucleotide Delivery Conjugates Having Enzyme Sensitive Linkages RNASE1, PNKP, POLM EPHX2 2337/4885CASP2 3364/4885CA12 382/4885

“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.