SCHEMBL972278

SCHEMBL972278

CCCOC(=O)C(N)Cc1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.57
ESR1 P03372 3/20 0.51
SLC6A2 P23975 2/20 0.51
ALDH1A1 P00352 1/20 0.51
CHRM1 P11229 1/20 0.51
TSHR P16473 1/20 0.51
KDR P35968 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
TAAR1 Q96RJ0 3/20 0.49
ESR2 Q92731 2/20 0.46
HDAC8 Q9BY41 2/20 0.44
TPH1 P17752 2/20 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
SCHEMBL972279 1.00 SLC7A5 (0.57) SLC7A5ESR1SLC6A2ALDH1A1CHRM1
Hydrochloric Acid SCHEMBL10587530 0.98 SLC7A5 (0.56) SLC7A5ESR1SLC6A2ALDH1A1CHRM1
Hydrochloric Acid SCHEMBL16007504 0.98 SLC7A5 (0.56) SLC7A5ESR1SLC6A2ALDH1A1CHRM1
SCHEMBL6001388 0.91 SLC7A5 (0.54) SLC7A5ESR1SLC6A2TSHRTAAR1
SCHEMBL16084879 0.91 SLC7A5 (0.54) SLC7A5ESR1SLC6A2TSHRTAAR1
SCHEMBL2271874 0.91 SLC7A5 (0.54) SLC7A5ESR1SLC6A2TSHRTAAR1
SCHEMBL17738628 0.90 SLC7A5 (0.65) SLC7A5ESR1SLC6A2TAAR1ESR2
SCHEMBL16007584 0.89 SLC7A5 (0.53) SLC7A5ESR1SLC6A2ALDH1A1CHRM1
SCHEMBL605205 0.89 SLC7A5 (0.53) SLC7A5ESR1SLC6A2ALDH1A1CHRM1
Hydrochloric Acid SCHEMBL27566032 0.89 SLC7A5 (0.53) SLC7A5ESR1SLC6A2TSHRTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103288630-A Synthesizing method of Salvianic acid A sodium UNIV SHANGHAI JIAOTONG 2013-09-11 CN claimed
CN-102093578-A Preparation method of shape-controllable amino-acid ester (with side group benzene ring) substituted polyphosphazene microspheres UNIV BEIJING CHEMICAL 2011-06-15 CN claimed
EP-1603549-A2 IMPROVED BIOAVAILABILITY AND IMPROVED DELIVERY OF ACIDIC PHARMACEUTICAL DRUGS Yu, Ruey J., Dr. (US) 2005-12-14 EP claimed
US-20040220264-A1 Bioavailability and improved delivery of acidic pharmaceutical drugs YU RUEY J 2004-11-04 US claimed
WO-2004082628-A2 IMPROVED BIOAVAILABILITY AND IMPROVED DELIVERY OF ACIDIC PHARMACEUTICAL DRUGS YU RUEY J (US) 2004-09-30 WO claimed
CN-120040435-A Mangiferin and derivatives thereof, preparation method and medical application thereof 安徽中医药大学 2025-05-27 CN disclosed
US-20200283479-A1 Treatments for Gastrointestinal Disorders IRONWOOD PHARMACEUTICALS INC (US) 2020-09-10 US disclosed
US-20200222541-A1 LINACLOTIDE COMPOSITIONS FOREST LABORATORIES HOLDINGS LTD (BM) 2020-07-16 US disclosed
US-20190345190-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2019-11-14 US disclosed
US-20190315785-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2019-10-17 US disclosed
EP-3539546-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS Gilead Sciences, Inc. (US) 2019-09-18 EP disclosed
CN-106822101-B A kind of epiphysin nano-composition and its preparation method and application 刘卫 2019-08-23 CN disclosed
US-20040157804-A1 Pre-organized tricyclic integrase inhibitor compounds GILEAD SCIENCES, INC. 2004-08-12 US disclosed
US-20040121316-A1 Method and compositions for identifying anti-HIV therapeutic compounds GILEAD SCIENCES, INC. 2004-06-24 US disclosed
WO-2004035577-A2 PRE-ORGANIZED TRICYCLIC INTEGRASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2004-04-29 WO disclosed
WO-2004035576-A2 PRE-ORGANIZED TRICYCLIC INTEGRASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2004-04-29 WO disclosed
WO-2003090691-A2 METHOD AND COMPOSITIONS FOR IDENTIFYING ANTI-HIV THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2003-11-06 WO disclosed
WO-2003090690-A2 CELLULAR ACCUMULATION OF PHOSPHONATE ANALOGS OF HIV PROTEASE INHIBITOR COMPOUNDS AND THE COMPOUNDS AS SUCH GILEAD SCIENCES, INC. (US) 2003-11-06 WO disclosed
WO-2003091264-A2 NON NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS GILEAD SCIENCES, INC. (US) 2003-11-06 WO disclosed
US-6150491-A PEROXIDATION OF AROMATIC COMPOUNDS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2000-11-21 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 (6 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-20200222541-A1 LINACLOTIDE COMPOSITIONS LPXN, LPAR3, LPAR5 SLC7A5 4314/4885ESR1 4729/4885SLC6A2 2037/4885
US-20040121316-A1 Method and compositions for identifying anti-HIV therapeutic compounds CES1, PNP, PGLS SLC7A5 3230/4885ESR1 1531/4885SLC6A2 4585/4885
US-20040157804-A1 Pre-organized tricyclic integrase inhibitor compounds INTS6, INTS9, MUS81 SLC7A5 1738/4885ESR1 201/4885SLC6A2 2156/4885
US-20190315785-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS PIK3CA, TYMP, ITPA SLC7A5 1173/4885ESR1 3308/4885SLC6A2 2815/4885
US-20200283479-A1 Treatments for Gastrointestinal Disorders GRPR, GIPR, GCGR SLC7A5 3754/4885ESR1 4721/4885SLC6A2 4041/4885
US-20190345190-A1 PHOSPHONATE ANALOGS OF HIV INHIBITOR COMPOUNDS PIK3CA, TYMP, ITPA SLC7A5 1173/4885ESR1 3308/4885SLC6A2 2815/4885

“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.