SCHEMBL638519

SCHEMBL638519

N[C@@H](Cc1ccc(O)cc1)C(=O)OO

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.65
TAAR1 Q96RJ0 3/20 0.50
SLC6A2 P23975 1/20 0.50
HDAC8 Q9BY41 2/20 0.49
ESR1 P03372 2/20 0.47
ESR2 Q92731 2/20 0.47
TYR P14679 1/20 0.45
DPP4 P27487 1/20 0.44
ALPI P09923 1/20 0.44
PKM P14618 1/20 0.44
PTGS1 P23219 1/20 0.44
XIAP P98170 1/20 0.44

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
SCHEMBL28267396 1.00 SLC7A5 (0.65) SLC7A5TAAR1SLC6A2HDAC8ESR1
SCHEMBL9523993 0.87 SLC7A5 (0.62) SLC7A5TAAR1SLC6A2HDAC8ESR1
SCHEMBL4453960 0.87 SLC7A5 (0.67) SLC7A5TAAR1SLC6A2HDAC8ESR1
SCHEMBL27680265 0.87 SLC7A5 (0.67) SLC7A5TAAR1SLC6A2HDAC8ESR1
SCHEMBL17738628 0.85 SLC7A5 (0.65) SLC7A5TAAR1SLC6A2HDAC8ESR1
SCHEMBL1253728 0.85 SLC7A5 (0.65) SLC7A5TAAR1SLC6A2HDAC8ESR1
SCHEMBL8012238 0.85 SLC7A5 (0.65) SLC7A5TAAR1SLC6A2HDAC8ESR1
SCHEMBL11456 0.85 SLC7A5 (0.65) SLC7A5TAAR1SLC6A2HDAC8ESR1
SCHEMBL18025358 0.85 SLC7A5 (0.65) SLC7A5TAAR1SLC6A2HDAC8ESR1
Tyrosine Methyl Ester SCHEMBL314923 0.84 ESR1 (0.63) SLC7A5TAAR1SLC6A2ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216524-A1 Chemoselective Rapid Azo-Coupling Reaction for Bioconjugation TRUSTEES BOSTON COLLEGE (US) 2024-07-04 US claimed
US-20180360984-A1 Chemoselective Rapid Azo-Coupling Reaction for Bioconjugation TRUSTEES OF BOSTON COLLEGE 2018-12-20 US claimed
EP-2306192-B1 Risk Markers For Cardiovascular Disease CLEVELAND CLINIC FOUNDATION (US) 2015-10-14 EP claimed
US-9005904-B2 Risk markers for cardiovascular disease THE CLEVELAND CLINIC FOUNDATION (US) 2015-04-14 US claimed
US-20150037905-A1 RISK MARKERS FOR CARDIOVASCULAR DISEASE THE CLEVELAND CLINIC FOUNDATION (US) 2015-02-05 US claimed
US-8722344-B2 Risk markers for cardiovascular disease THE CLEVELAND CLINIC FOUNDATION (US) 2014-05-13 US claimed
CN-103458888-A Nutritional compositions comprising branched chain fatty acids for improving intestinal barrier function NESTEC SA 2013-12-18 CN claimed
US-20130177551-A1 RISK MARKERS FOR CARDIOVASCULAR DISEASE HAZEN STANLEY L (US) 2013-07-11 US claimed
US-8338110-B2 determining levels of one or more oxidized apolipoprotien A-I related biomolecules in a bodily sample; atherosclerosis THE CLEVELAND CLINIC FOUNDATION (US) 2012-12-25 US claimed
EP-1697746-B1 RISK MARKERS FOR CARDIOVASCULAR DISEASE CLEVELAND CLINIC FOUNDATION (US) 2012-02-22 EP claimed
EP-2306192-A2 Risk Markers For Cardiovascular Disease The Cleveland Clinic Foundation (US) 2011-04-06 EP claimed
US-7781219-B2 determining levels of one or more oxidized apolipoprotien A-I related biomolecules in a bodily sample; atherosclerosis THE CLEVELAND CLINIC FOUNDATION (US) 2010-08-24 US claimed
US-20100183607-A1 RISK MARKERS FOR CARDIOVASCULAR DISEASE THE CLEVELAND CLINIC FOUNDATION (US) 2010-07-22 US claimed
EP-1697746-A4 RISK MARKERS FOR CARDIOVASCULAR DISEASE CLEVELAND CLINIC FOUNDATION (US) 2007-08-29 EP claimed
US-20070178554-A1 Orthogonal Aminoacyl Synthetase-tRNA Pairs for Incorporating Unnatural Amino Acids Into Proteins NEURION PHARMACEUTICALS, INC. 2007-08-02 US claimed
EP-1697746-A2 RISK MARKERS FOR CARDIOVASCULAR DISEASE The Cleveland Clinic Foundation (US) 2006-09-06 EP claimed
WO-2006039717-A2 METHODS OF DETERMINING PRECISE HERG INTERACTIONS AND ALTERING COMPOUNDS BASED ON SAID INTERACTIONS NEURION PHARMACEUTICALS, INC. (US) 2006-04-13 WO claimed
US-20060014159-A1 Methods of determining precise HERG interactions and designing compounds based on said interactions NEURION PHARMACEUTICALS, INC. (US) 2006-01-19 US claimed
US-20050239136-A1 Risk markers for cardiovacular disease THE CLEVELAND CLINIC FOUNDATION 2005-10-27 US claimed
WO-2005055810-A2 RISK MARKERS FOR CARDIOVASCULAR DISEASE THE CLEVELAND CLINIC FOUNDATION (US) 2005-06-23 WO 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 (4 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-20060014159-A1 Methods of determining precise HERG interactions and designing compounds based on said interactions KCNN4, KCNC1, HCN4 SLC7A5 810/4885TAAR1 3479/4885SLC6A2 1280/4885
US-20240216524-A1 Chemoselective Rapid Azo-Coupling Reaction for Bioconjugation PAICS, DNPEP, ABCG2 SLC7A5 127/4885TAAR1 2476/4885SLC6A2 1927/4885
US-20180360984-A1 Chemoselective Rapid Azo-Coupling Reaction for Bioconjugation PAICS, DNPEP, ABCG2 SLC7A5 127/4885TAAR1 2476/4885SLC6A2 1927/4885
US-20070178554-A1 Orthogonal Aminoacyl Synthetase-tRNA Pairs for Incorporating Unnatural Amino Acids Into Proteins AARS1, GARS1, TRMT1 SLC7A5 171/4885TAAR1 3883/4885SLC6A2 2705/4885

“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.