SCHEMBL7149699

SCHEMBL7149699

CCCCOC(=O)CCC(N)=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.58
DGKA P23743 1/20 0.55
PRSS1 P07477 1/20 0.51
PRSS2 P07478 1/20 0.51
PRSS3 P35030 1/20 0.51
ALDH1A1 P00352 3/20 0.50
NAAA Q02083 1/20 0.50
ATM Q13315 1/20 0.47
DNM1 Q05193 1/20 0.46
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
ADRA2A P08913 1/20 0.43
ADRA1A P35348 1/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MAPT P10636 2/20 0.43
RAB9A P51151 1/20 0.43
RAD52 P43351 1/20 0.43
THRB P10828 1/20 0.42
CNR1 P21554 1/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL5665518 0.92 HTR2C (0.69) HTR2CDGKAPRSS1PRSS2PRSS3
SCHEMBL23982999 0.92 HTR2C (0.69) HTR2CDGKAPRSS1PRSS2PRSS3
SCHEMBL13493855 0.92 DGKA (0.61) HTR2CDGKAPRSS1PRSS2PRSS3
SCHEMBL28860834 0.92 DGKA (0.67) HTR2CDGKAPRSS1PRSS2PRSS3
Dibutylsuccinate SCHEMBL50411 0.89 DGKA (0.67) HTR2CDGKAPRSS1PRSS2PRSS3
Dibutylsuccinate SCHEMBL3977806 0.89 DGKA (0.67) HTR2CDGKAPRSS1PRSS2PRSS3
Palmitamide SCHEMBL8397170 0.88 DGKA (0.74) HTR2CDGKAPRSS1PRSS2PRSS3
SCHEMBL28271588 0.88 DGKA (0.74) HTR2CDGKAPRSS1PRSS2PRSS3
Octadecanoic Acid Amide SCHEMBL6244875 0.88 DGKA (0.74) HTR2CDGKAPRSS1PRSS2PRSS3
Dibutylsuccinate SCHEMBL7705415 0.87 HTR2C (0.67) HTR2CDGKAPRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104981694-A Lipid membrane encapsulated particles with membrane proteins AIT AUSTRIAN INST TECHNOLOGY 2015-10-14 CN disclosed
CN-102898395-B Method for preparing 4-methyl-5-n-butoxy oxazole DAFENG HEGNO PHARMACEUTICALS CO LTD 2015-03-11 CN disclosed
US-8410306-B2 Method of producing a carboxylic alkyl ester BASF SE (DE) 2013-04-02 US disclosed
US-8410306-B2 Method of producing a carboxylic alkyl ester BASF SE (DE) 2013-04-02 US disclosed
CN-102898395-A Method for preparing 4-methyl-5-n-butoxy oxazole DAFENG HAIJIANUO PHARMACEUTICAL CO LTD 2013-01-30 CN disclosed
EP-2266954-A1 Novel bifunctional chelating compounds containing hydroxamic acid residues Draximage, Inc. (CA) 2010-12-29 EP disclosed
EP-2266953-A1 Novel bifunctional chelating compounds containing hydroxamic acid residues Draximage, Inc. (CA) 2010-12-29 EP disclosed
US-20090137825-A1 METHOD OF PRODUCING A CARBOXYLIC ALKYL ESTER BASF AKTIENGESELLSCHAFT (DE) 2009-05-28 US disclosed
US-20090137825-A1 METHOD OF PRODUCING A CARBOXYLIC ALKYL ESTER BASF AKTIENGESELLSCHAFT (DE) 2009-05-28 US disclosed
WO-2007116005-A1 METHOD OF PRODUCING A CARBOXYLIC ALKYL ESTER BASF SE (DE) 2007-10-18 WO disclosed
US-6506772-B1 Pharmaceutically active salts thereof with activity as adenosine receptor ligands are disclosed. These compounds are the adenosine receptor. HOFFMANN-LA ROCHE INC. 2003-01-14 US disclosed
CN-1314906-A Salts of paroxetine SMITHKLINE BEECHAM PLC (GB) 2001-09-26 CN 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 (1 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-20090137825-A1 METHOD OF PRODUCING A CARBOXYLIC ALKYL ESTER CPS1, ACMSD, PCCA HTR2C 4439/4885DGKA 354/4885PRSS1 4389/4885

“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.