SCHEMBL28513

SCHEMBL28513

N[C@H](C(=O)O)C(Cl)c1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.44
NR1I2 O75469 1/20 0.44
PTGS1 P23219 1/20 0.44
ADRA1A P35348 1/20 0.44
LMNA P02545 1/20 0.44
BLM P54132 1/20 0.44
SRC P12931 1/20 0.44
SLC7A5 Q01650 1/20 0.44
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
CYP2C9 P11712 4/20 0.42
CYP2D6 P10635 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 1/20 0.41
GRM8 O00222 1/20 0.41
GRM4 Q14833 1/20 0.41
SLC1A3 P43003 2/20 0.40
SLC1A2 P43004 2/20 0.40
SLC1A1 P43005 2/20 0.40

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
SCHEMBL29779 1.00 TDP1 (0.44) TDP1NR1I2PTGS1ADRA1ALMNA
Hydrochloric Acid SCHEMBL28838130 0.98 TDP1 (0.43) TDP1NR1I2PTGS1ADRA1ALMNA
SCHEMBL6807352 0.83 CYP2D6 (0.48) LMNASRCCYP2D6SLC1A3SLC1A2
SCHEMBL14935796 0.83 CYP2D6 (0.48) LMNASRCCYP2D6SLC1A3SLC1A2
SCHEMBL6947260 0.83 CYP2D6 (0.48) LMNASRCCYP2D6SLC1A3SLC1A2
Hydrochloric Acid SCHEMBL8695663 0.82 CYP2D6 (0.46) LMNASRCCYP2D6SLC1A3SLC1A2
Methane SCHEMBL4340079 0.82 CYP2D6 (0.46) LMNASRCCYP2D6SLC1A3SLC1A2
SCHEMBL22074716 0.79 TDP1 (0.67) TDP1NR1I2PTGS1ADRA1ALMNA
SCHEMBL304041 0.79 TDP1 (0.47) TDP1NR1I2PTGS1ADRA1ALMNA
SCHEMBL16826249 0.79 TDP1 (0.47) TDP1NR1I2PTGS1ADRA1ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3869192-B1 METHOD FOR QUANTITATIVE DETECTION OF VARIOUS METABOLITES IN BIOLOGICAL SAMPLE HUMAN METABOLOMICS INST INC (CN) 2026-05-13 EP claimed
US-12600699-B2 Thiosemicarbazates and uses thereof THE FEINSTEIN INSTITUTES FOR MEDICAL RESEARCH (US) 2026-04-14 US claimed
US-20250258146-A1 QUANTITATIVE DETECTION METHOD OF MULTIPLE METABOLITES IN BIOLOGICAL SAMPLE AND METABOLIC CHIP HUMAN METABOLOMICS INSTITUTE INC. (CN) 2025-08-14 US claimed
US-12351573-B2 Compounds for use in synthesis of peptidomimetics THE FEINSTEIN INSTITUTES FOR MEDICAL RESEARCH (US) 2025-07-08 US claimed
CN-119424050-A Degradable valve frame and heart valve 元心科技(深圳)有限公司 2025-02-14 CN claimed
WO-2025026273-A1 DEGRADABLE VALVE STENT, VALVE STENT FOR PULMONARY ARTERIAL VALVE, PULMONARY ARTERIAL VALVE, AND HEART VALVE 元心科技(深圳)有限公司 2025-02-06 WO claimed
EP-3655036-B1 COMPOSITIONS FOR TREATING STRESS-RELATED DISORDERS HOFFMAN TECH LLC (US) 2024-09-04 EP claimed
US-20240209409-A1 Method for Secretory Production of Unnatural-Amino-Acid-Containing Protein AJINOMOTO CO., INC. (JP) 2024-06-27 US claimed
EP-4368722-A1 METHOD FOR SECRETORY PRODUCTION OF UNNATURAL-AMINO-ACID-CONTAINING PROTEIN AJINOMOTO CO., INC. (JP) 2024-05-15 EP claimed
US-11931329-B2 Compositions and methods for treating anxiety-related disorders YAMO PHARMACEUTICALS LLC (US) 2024-03-19 US claimed
US-20130274176-A1 BETA-ARRESTIN EFFECTORS AND COMPOSITIONS AND METHODS OF USE THEREOF TREVENA, INC. (US) 2013-10-17 US claimed
WO-2013109610-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS HOFFMAN STEVEN (US) 2013-07-25 WO claimed
US-20130184214-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2013-07-18 US claimed
US-8481498-B1 Pharmaceutical compositions and methods OXFORD FINANCE LLC, AS COLLATERAL AGENT 2013-07-09 US claimed
CN-102333536-A Ss-arrestin effectors and compositions and methods of use thereof TREVENA INC 2012-01-25 CN claimed
EP-2376101-A2 ß-ARRESTIN EFFECTORS AND COMPOSITIONS AND METHODS OF USE THEREOF Trevena, Inc. (US) 2011-10-19 EP claimed
US-20100184701-A1 Beta-Arrestin Effectors And Compositions And Methods Of Use Thereof TREVENA, INC. 2010-07-22 US claimed
WO-2010077339-A2 β-ARRESTIN EFFECTORS AND COMPOSITIONS AND METHODS OF USE THEREOF TREVENA, INC. (US) 2010-07-08 WO claimed
US-20090011055-A1 Plasminogen Activator Inhibitor-1 Inhibitors And Methods Of Use Thereof To Modulate Lipid Metabolism THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-01-08 US claimed
WO-2008131047-A2 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITORS AND METHODS OF USE THEREOF TO MODULATE LIPID METABOLISM THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-10-30 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 (5 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-12351573-B2 Compounds for use in synthesis of peptidomimetics DNPEP, NPEPPS, PAM TDP1 3027/4885NR1I2 4566/4885PTGS1 2925/4885
US-20090011055-A1 Plasminogen Activator Inhibitor-1 Inhibitors And Methods Of Use Thereof To Modulate Lipid Metabolism SERPINE1, PLAT, SERPINB1 TDP1 2746/4885NR1I2 1060/4885PTGS1 355/4885
US-20130274176-A1 BETA-ARRESTIN EFFECTORS AND COMPOSITIONS AND METHODS OF USE THEREOF ARRB1, ADRB1, ADRB3 TDP1 2200/4885NR1I2 1507/4885PTGS1 4070/4885
US-20100184701-A1 Beta-Arrestin Effectors And Compositions And Methods Of Use Thereof ARRB1, ADRB1, ADRB3 TDP1 2200/4885NR1I2 1507/4885PTGS1 4070/4885
US-12600699-B2 Thiosemicarbazates and uses thereof MET, THRB, ABAT TDP1 2893/4885NR1I2 2038/4885PTGS1 3489/4885

“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.