SCHEMBL1462191

SCHEMBL1462191

C=C(NCCCCC)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 12/20 0.56
ZDHHC20 Q5W0Z9 1/20 0.52
ZDHHC2 Q9UIJ5 1/20 0.52
CASP2 P42575 1/20 0.50
NAAA Q02083 2/20 0.47
PLA2G2A P14555 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
DPP7 Q9UHL4 1/20 0.44
ALOX15 P16050 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL3277865 0.98 EPHX1 (0.59) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL28199266 0.98 EPHX1 (0.59) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL8931322 0.98 EPHX1 (0.59) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL3278820 0.98 EPHX1 (0.59) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL3278553 0.98 EPHX1 (0.59) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL3283012 0.93 EPHX1 (0.50) EPHX1ZDHHC20ZDHHC2CASP2ALOX15
SCHEMBL3279311 0.84
SCHEMBL9580786 0.81 EPHX1 (0.54) EPHX1ZDHHC20ZDHHC2CASP2NAAA
SCHEMBL1005047 0.79 HDAC1 (0.44) EPHX1ZDHHC20ZDHHC2ALOX15
SCHEMBL3762004 0.79 EPHX1 (0.57) EPHX1ZDHHC20ZDHHC2CASP2NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115650885-A Preparation method of N-acyl-2-amino acrylate 新乡学院 2023-01-31 CN claimed
US-20070113353-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY 2007-05-24 US claimed
US-7214813-B2 Preparation of chiral cyclic amino acids and derivatives THE PENN STATE RESEARCH FOUNDATION (US) 2007-05-08 US claimed
US-20040242889-A1 Preparation of chiral cyclic amino acids and derivatives THE PENN STATE RESEARCH FOUNDATION 2004-12-02 US claimed
WO-2004011414-A1 E-ISOMERIC β-AROMATIC OR HETEROAROMATIC SUBSTITUTED β-ACYLAMINO-ACRYLATES AND METHODS OF PREPARING THE SAME DSM IP ASSETS B.V. (NL) 2004-02-05 WO claimed
EP-0705815-B1 Process for the preparation of N-arylaminoacrylic acid derivatives BAYER AG (DE) 1998-01-14 EP claimed
US-5672708-A Process for the preparation of N-arylaminoacrylic acid derivatives and the use of N-arylaminoacrylic acid derivatives thus prepared for the preparation of 4-quinolone-3-carboxylic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1997-09-30 US claimed
WO-1993001199-A1 CHIRAL PHOSPHOLANES VIA CHIRAL 1,4-DIOL CYCLIC SULFATES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-01-21 WO claimed
US-4328364-A RHODIUM CATALYST SNAMPROGETTI, S.P.A. (IT) 1982-05-04 US claimed
EP-0031877-A1 Optically active 1,2-Bis-(diphenylphosphino)-compounds, metal complexes containing them as chiral ligands and their use Degussa Aktiengesellschaft (DE) 1981-07-15 EP claimed
JP-54154712-A None JP disclosed
JP-54057490-A None JP disclosed
CN-118184525-A Preparation method of N-substituted-2-amino acrylic ester 武汉轻工大学 2024-06-14 CN disclosed
CN-115650885-A Preparation method of N-acyl-2-amino acrylate 新乡学院 2023-01-31 CN disclosed
CN-115650885-A Preparation method of N-acyl-2-amino acrylate 新乡学院 2023-01-31 CN disclosed
EP-0031877-A1 Optically active 1,2-Bis-(diphenylphosphino)-compounds, metal complexes containing them as chiral ligands and their use Degussa Aktiengesellschaft (DE) 1981-07-15 EP disclosed
US-4194050-A HYDROGENATING OXIMES HAVING AN ALPHA-HYDROGEN USING A RUTHENIUM CATALYST AND A CARBOXYLIC ANHYDRIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-03-18 US disclosed
JP-S54154712-A PREPARATION OF OPTICALLY ACTIVE OMEGA-CYANO-ALPHA-ACYLAMINO DERIVATIVE SUMITOMO CHEM CO LTD 1979-12-06 JP disclosed
JP-S5457490-A ASYMMETRIC HYDROGENATION CATALYST AJINOMOTO CO INC 1979-05-09 JP disclosed
US-4137417-A Process for producing an enamide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-01-30 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 (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-20040242889-A1 Preparation of chiral cyclic amino acids and derivatives AADAT, PAM, BCAT2 EPHX1 4177/4885ZDHHC20 4350/4885ZDHHC2 3922/4885

“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.