SCHEMBL244193

SCHEMBL244193

N[C@@H](Cc1ccccc1)[C@H](O)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.62
PKM P14618 1/20 0.62
PTGS1 P23219 1/20 0.62
XIAP P98170 1/20 0.62
SLC7A5 Q01650 1/20 0.62
SLC15A1 P46059 2/20 0.57
LAP3 P28838 7/20 0.56
ANPEP P15144 2/20 0.56
RNPEP Q9H4A4 1/20 0.56
DNPEP Q9ULA0 1/20 0.56
SLC1A3 P43003 2/20 0.56
SLC1A2 P43004 2/20 0.56
SLC1A1 P43005 2/20 0.56
CYP1A2 P05177 1/20 0.55
LTA4H P09960 2/20 0.55
SRR Q9GZT4 2/20 0.52
EPHX1 P07099 1/20 0.50
CPA1 P15085 1/20 0.48
CPA3 P15088 1/20 0.48

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
SCHEMBL7415433 1.00 ALPI (0.62) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL7436847 1.00 ALPI (0.62) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL7698421 1.00 ALPI (0.62) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL5491058 1.00 ALPI (0.62) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL2201323 1.00 ALPI (0.62) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL2029167 1.00 ALPI (0.62) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL650855 1.00 ALPI (0.62) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL3841332 1.00 ALPI (0.62) ALPIPKMPTGS1XIAPSLC7A5
Hydrochloric Acid SCHEMBL1309497 0.98 ALPI (0.60) ALPIPKMPTGS1XIAPSLC7A5
Hydrochloric Acid SCHEMBL3688220 0.98 ALPI (0.60) ALPIPKMPTGS1XIAPSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140255523-A1 Use of Tiliacora Triandra in Cosmetics and Compositions Thereof AVON PRODUCTS, INC. (US) 2014-09-11 US claimed
EP-2588062-A1 USE OF TILIACORA TRIANDRA IN COSMETICS AND COMPOSITIONS THEREOF Avon Products, Inc. (US) 2013-05-08 EP claimed
US-20120003331-A1 Use of Tiliacora Triandra in Cosmetics and Compositions Thereof AVON PRODUCTS, INC. (US) 2012-01-05 US claimed
WO-2012002950-A1 USE OF TILIACORA TRIANDRA IN COSMETICS AND COMPOSITIONS THEREOF AVON PRODUCTS, INC. (US) 2012-01-05 WO claimed
WO-2011081698-A1 CGRP COMPOSITIONS AND USES THEREOF AVON PRODUCTS, INC. (US) 2011-07-07 WO claimed
US-20110159125-A1 CGRP Compositions and Uses Thereof AVON PRODUCTS, INC. (US) 2011-06-30 US claimed
US-5516930-A Intermediates in the production beta aminoalcohols HOFFMANN-LA ROCHE INC. (US) 1996-05-14 US claimed
JP-11100358-A None JP disclosed
JP-10182601-A None JP disclosed
JP-10059909-A None JP disclosed
EP-2588062-B1 USE OF TILIACORA TRIANDRA IN COSMETICS AND COMPOSITIONS THEREOF AVON PROD INC (US) 2019-05-29 EP disclosed
US-9687440-B2 CGRP compositions and uses thereof AVON PRODUCTS, INC (US) 2017-06-27 US disclosed
EP-2890359-B1 DICKKOPF-1 EXPRESSION MODULATING COMPOSITIONS AND USES THEREOF AVON PROD INC (US) 2016-10-05 EP disclosed
EP-0751145-A2 HIV-protease inhibitors Japan Energy Corporation (JP) 1997-01-02 EP disclosed
US-5578730-A Process for producing β-aminoalcohols compounds HOFFMANN-LA ROCHE INC. (US) 1996-11-26 US disclosed
US-5516930-A Intermediates in the production beta aminoalcohols HOFFMANN-LA ROCHE INC. (US) 1996-05-14 US disclosed
US-5512682-A Nitrile compounds useful as intermediates in the production of beta amino alcohols HOFFMANN-LA ROCHE INC. (US) 1996-04-30 US disclosed
US-5512688-A METHANESULFONIC ACID(4S,-5S)-4-BENZYL-2-OXO-OXAZOLIDINE -5YLMETHYL ESTER; CHEMICAL INTERMEDIATE FOR FORMING CERTAIN AMINO ACID DERIVATIVES USEFUL AS PHROPHYLAXIS OR TRETAMENT OF RITRO-VIRAL INFECTIONS HOFFMANN-LA ROCHE INC. (US) 1996-04-30 US disclosed
US-5495025-A Isoindole compounds which are useful as intermediates HOFFMANN-LA ROCHE INC. (US) 1996-02-27 US disclosed
US-5455353-A 4-(benzyl-2-oxo-oxazolidin-5 ylmethyl)N tertbutyl-decahydroisoquinoline-3-carboxamides HOFFMANN-LA ROCHE INC. (US) 1995-10-03 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 (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-20120003331-A1 Use of Tiliacora Triandra in Cosmetics and Compositions Thereof CUTA, COL14A1, COL1A1 ALPI 1656/4885PKM 3566/4885PTGS1 2494/4885
US-20140255523-A1 Use of Tiliacora Triandra in Cosmetics and Compositions Thereof CUTA, COL14A1, COL1A1 ALPI 1672/4885PKM 3425/4885PTGS1 2595/4885

“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.