SCHEMBL2390939

SCHEMBL2390939

C=CCCCCCCCC#N

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
TSHR P16473 3/20 0.46
TRPA1 O75762 3/20 0.41
USP2 O75604 2/20 0.41
MAPT P10636 2/20 0.39
ABCC4 O15439 1/20 0.39
TDP1 Q9NUW8 1/20 0.35
LPAR3 Q9UBY5 2/20 0.34
LMNA P02545 1/20 0.34
LPAR2 Q9HBW0 1/20 0.34
HIF1A Q16665 2/20 0.34
EPAS1 Q99814 2/20 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
SCHEMBL515417 1.00 ALDH1A1 (0.62) ALDH1A1TSHRTRPA1USP2MAPT
SCHEMBL3119157 1.00 ALDH1A1 (0.62) ALDH1A1TSHRTRPA1USP2MAPT
SCHEMBL347298 1.00 ALDH1A1 (0.62) ALDH1A1TSHRTRPA1USP2MAPT
SCHEMBL28285571 1.00 ALDH1A1 (0.62) ALDH1A1TSHRTRPA1USP2MAPT
SCHEMBL14675841 1.00 ALDH1A1 (0.62) ALDH1A1TSHRTRPA1USP2MAPT
SCHEMBL515877 1.00
SCHEMBL1727419 1.00 ALDH1A1 (0.62) ALDH1A1TSHRTRPA1USP2MAPT
SCHEMBL30319228 1.00 ALDH1A1 (0.62) ALDH1A1TSHRTRPA1USP2MAPT
SCHEMBL151637 0.97
SCHEMBL150327 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2941415-B1 CROSS METATHESIS PROCESS ARKEMA FRANCE (FR) 2017-04-26 EP claimed
EP-2941413-B1 PROCESS FOR THE SYNTHESIS OF OMEGA-UNSATURATED NITRILE-ACID/ESTER IN WHICH TWO TYPES OF CROSS METATHESIS ARE ALTERNATED CONSECUTIVELY, SWING PROCESS ARKEMA FRANCE (FR) 2016-10-19 EP claimed
EP-2566842-B1 PROCESS FOR PREPARING SATURATED AMINO ACIDS OR SATURATED AMINO ESTERS COMPRISING A METATHESIS STEP ARKEMA FRANCE (FR) 2016-05-04 EP claimed
US-20150336879-A1 PROCESS FOR THE SYNTHESIS OF OMEGA-UNSATURATED NITRILE-ACID/ESTER IN WHICH TWO TYPES OF CROSS METATHESIS ARE ALTERNATED CONSECUTIVELY, SWING PROCESS ARKEMA FRANCE (FR) 2015-11-26 US claimed
EP-2941415-A1 CROSS METATHESIS PROCESS Arkema France (FR) 2015-11-11 EP claimed
EP-2941413-A1 PROCESS FOR THE SYNTHESIS OF OMEGA-UNSATURATED NITRILE-ACID/ESTER IN WHICH TWO TYPES OF CROSS METATHESIS ARE ALTERNATED CONSECUTIVELY, SWING PROCESS Arkema France (FR) 2015-11-11 EP claimed
EP-2941414-A1 CROSS METATHESIS PROCESS Arkema France (FR) 2015-11-11 EP claimed
US-9096490-B2 Process for preparing saturated amino acids or saturated amino esters comprising a metathesis step ARKEMA FRANCE (FR) 2015-08-04 US claimed
US-20140194584-A1 Process for the synthesis of w-Unsaturated nitrile-acid/ester in which two types of cross metathesis are alternated consecutively swing process ARKEMA FRANCE (FR) 2014-07-10 US claimed
WO-2014106766-A1 PROCESS FOR THE SYNTHESIS OF OMEGA-UNSATURATED NITRILE-ACID/ESTER IN WHICH TWO TYPES OF CROSS METATHESIS ARE ALTERNATED CONSECUTIVELY, SWING PROCESS ARKEMA FRANCE (FR) 2014-07-10 WO claimed
WO-2011138051-A1 PROCESS FOR PREPARING SATURATED AMINO ACIDS OR SATURATED AMINO ESTERS COMPRISING A METATHESIS STEP ARKEMA FRANCE (FR) 2011-11-10 WO claimed
US-7479531-B2 Copolymer of ethylene and/or propylene; and octen-1-ol,7-octen-1-ol trimethylsilyl ether, octenyl acetate, 5-norbornen-2-yl acetate, 5-norbornen-2-ol and/or 5-norbornen-2-ol trimethylsilyl ether; transition metal catalyst comprising 2-arylazo- or 2-arylphosphazo- phenoxide ligand EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-01-20 US claimed
US-7285609-B2 Olefin polymerization catalyst system useful for polar monomers EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-23 US claimed
EP-1626999-B1 OLEFIN POLYMERIZATION CATALYST SYSTEM USEFUL FOR POLAR MONOMERS EXXONMOBIL CHEM PATENTS INC (US) 2007-09-26 EP claimed
US-20070197751-A1 Olefin polymerization catalyst system useful for polar monomers EXXONMOBIL CHEMICAL PATENTS INC. 2007-08-23 US claimed
EP-1626999-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM USEFUL FOR POLAR MONOMERS Exxonmobil Chemical Patents Inc. (US) 2006-02-22 EP claimed
US-20040260043-A1 Olefin polymerization catalyst system useful for polar monomers EXXONMOBIL CHEMICAL PATENTS, INC. 2004-12-23 US claimed
WO-2004101634-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM USEFUL FOR POLAR MONOMERS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-11-25 WO claimed
US-4217299-A Method for converting unsaturated compound having functional group JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1980-08-12 US claimed
US-3974196-A Method for disproportionating ethylenically unsaturated compounds having functional ester groups JAPAN SYNTHETIC RUBBER CO., LTD. (JA) 1976-08-10 US claimed

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-20150336879-A1 PROCESS FOR THE SYNTHESIS OF OMEGA-UNSATURATED NITRILE-ACID/ESTER IN WHICH TWO TYPES OF CROSS METATHESIS ARE ALTERNATED CONSECUTIVELY, SWING PROCESS FASN, METTL14, ALOX12 ALDH1A1 249/4885TSHR 4629/4885TRPA1 2508/4885
US-20140194584-A1 Process for the synthesis of w-Unsaturated nitrile-acid/ester in which two types of cross metathesis are alternated consecutively swing process FASN, METTL14, ELOVL1 ALDH1A1 352/4885TSHR 4772/4885TRPA1 2609/4885

“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.