SCHEMBL4153723

SCHEMBL4153723

CC(=O)NC(Cc1ccc(O)cc1)C(=O)c1ccccc1C(C)N

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.45
OPRD1 P41143 5/20 0.44
OPRM1 P35372 4/20 0.44
OPRK1 P41145 1/20 0.44
CPA1 P15085 1/20 0.43
CPA2 P48052 1/20 0.43
CPA4 Q9UI42 1/20 0.43
MME P08473 1/20 0.43
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
FOLH1 Q04609 1/20 0.41
PAM P19021 1/20 0.41
TSHR P16473 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
SLC7A5 Q01650 1/20 0.41
TACR1 P25103 1/20 0.41
TAAR1 Q96RJ0 2/20 0.41

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
Acetyl Tyrosine SCHEMBL28266147 0.75 FOLH1 (0.62) GRIA1CPA1MMEFOLH1SLC7A5
SCHEMBL468899 0.74 ACE (0.55) GRIA1FOLH1SLC7A5TAAR1
SCHEMBL6518708 0.74 ACE (0.55) GRIA1FOLH1SLC7A5TAAR1
SCHEMBL26778812 0.74 ESR1 (0.54) GRIA1CPA1CPA2CPA4MME
SCHEMBL12313515 0.74 ESR1 (0.54) GRIA1CPA1CPA2CPA4MME
SCHEMBL5490272 0.74 ESR1 (0.54) GRIA1CPA1CPA2CPA4MME
SCHEMBL4152633 0.73 ESR1 (0.47) SLC7A5TAAR1
SCHEMBL12537153 0.73 FOLH1 (0.51) GRIA1CPA1CPA2CPA4MME
Acetyl Tyrosine SCHEMBL8938057 0.72 MME (0.55) OPRD1OPRM1OPRK1MMEFOLH1
Acetyl Tyrosine SCHEMBL8977601 0.72 FOLH1 (0.66) GRIA1CPA1MMEFOLH1SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1876169-B1 PHENYL-CONTAINING N-ACYL AMINE AND AMINOACID DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF, A PHARMACEUTICAL COMPOSITION AND THE USE THEREOF OBSCHESTVO S OGRANICHENNOI OTVETSTENNOSTIYU PHARMENTPR (RU) 2015-12-30 EP claimed
US-8309766-B2 Phenyl-containing n-acyl amine and aminoacid derivatives, methods for the production thereof, a pharmaceutical composition and the use thereof Obschestvo S. Organichennoi Otvetstvennostiyu Pharmenterprises (RU) 2012-11-13 US claimed
US-20090111874-A1 Phenyl-containing n-acyl amine and aminoacid derivatives, methods for the production thereof, a pharmaceutical composition and the use thereof OBSCHESTVO S OGRANICHENNOI OTVETSTVENNOSTIYU PHARMENTERPRISES (RU) 2009-04-30 US claimed
EP-1876169-A1 PHENYL-CONTAINING N-ACYL AMINE AND AMINOACID DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF, A PHARMACEUTICAL COMPOSITION AND THE USE THEREOF Obschestvo S Ogranichennoi Otvetstennostiyu "Pharmenterprises" (RU) 2008-01-09 EP claimed
EP-1876169-B1 PHENYL-CONTAINING N-ACYL AMINE AND AMINOACID DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF, A PHARMACEUTICAL COMPOSITION AND THE USE THEREOF OBSCHESTVO S OGRANICHENNOI OTVETSTENNOSTIYU PHARMENTPR (RU) 2015-12-30 EP disclosed
US-8309766-B2 Phenyl-containing n-acyl amine and aminoacid derivatives, methods for the production thereof, a pharmaceutical composition and the use thereof Obschestvo S. Organichennoi Otvetstvennostiyu Pharmenterprises (RU) 2012-11-13 US disclosed
US-20090111874-A1 Phenyl-containing n-acyl amine and aminoacid derivatives, methods for the production thereof, a pharmaceutical composition and the use thereof OBSCHESTVO S OGRANICHENNOI OTVETSTVENNOSTIYU PHARMENTERPRISES (RU) 2009-04-30 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-20090111874-A1 Phenyl-containing n-acyl amine and aminoacid derivatives, methods for the production thereof, a pharmaceutical composition and the use thereof PAH, MAOA, APEH GRIA1 626/4885OPRD1 179/4885OPRM1 126/4885

“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.