SCHEMBL680475

SCHEMBL680475

NN(CC(=O)O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.44
ALDH1A1 P00352 3/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
GLA P06280 1/20 0.42
TSHR P16473 1/20 0.42
AKR1B1 P15121 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ADRA2C P18825 1/20 0.38
TP53 P04637 1/20 0.37

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
Hydrochloric Acid SCHEMBL4501078 0.98 NPSR1 (0.43) NPSR1ALDH1A1KMT2ANPC1POLB
SCHEMBL11085642 0.84 CA2 (0.45) ALDH1A1HTTCYP3A4
SCHEMBL5252736 0.84 NPSR1 (0.43) NPSR1ALDH1A1KMT2ANPC1POLB
SCHEMBL9795580 0.83 SMN1; SMN2 (0.59) SMN1; SMN2
SCHEMBL8781767 0.83 ALDH1A1 (0.44) NPSR1ALDH1A1KMT2ANPC1POLB
SCHEMBL9779961 0.81 KEAP1 (0.40) HTT
SCHEMBL9795712 0.81 KEAP1 (0.40) KMT2ASMN1; SMN2MEN1
SCHEMBL9780001 0.81 KEAP1 (0.53) ALDH1A1KMT2ARAB9ASMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL4512905 0.79 KEAP1 (0.39) CYP3A4
SCHEMBL11669414 0.79 ALDH1A1 (0.41) NPSR1ALDH1A1KMT2ANPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114743800-B Preparation method of polyacrylic acid/graphene-based flexible electrode material 武夷学院 2023-07-21 CN claimed
CN-114743800-A Preparation method of polyacrylic acid/graphene-based flexible electrode material 武夷学院 2022-07-12 CN claimed
US-8969288-B2 Amide based glucagon and superfamily peptide prodrugs INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2015-03-03 US claimed
CN-102325539-A Amide based glucagon superfamily peptide prodrugs UNIV INDIANA RES & TECH CORP 2012-01-18 CN claimed
US-20110288003-A1 AMIDE BASED GLUCAGON AND SUPERFAMILY PEPTIDE PRODRUGS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2011-11-24 US claimed
EP-2376097-A1 AMIDE BASED GLUCAGON SUPERFAMILY PEPTIDE PRODRUGS Indiana University Research and Technology Corporation (US) 2011-10-19 EP claimed
WO-2010071807-A1 AMIDE BASED GLUCAGON SUPERFAMILY PEPTIDE PRODRUGS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2010-06-24 WO claimed
EP-1483285-A1 INHIBITORS OF THE BLOOD-CLOTTING FACTOR Xa, PRODUCTION THEREOF AND USE OF THE SAME Curacyte AG (DE) 2004-12-08 EP claimed
WO-2003076457-A1 INHIBITORS OF THE BLOOD-CLOTTING FACTOR Xa, PRODUCTION THEREOF AND USE OF THE SAME CURACYTE AG (DE) 2003-09-18 WO claimed
US-4443371-A LEATHER, PAPER ALTHOUSE TERTRE, S.A. (BE) 1984-04-17 US claimed
CN-114743800-B Preparation method of polyacrylic acid/graphene-based flexible electrode material 武夷学院 2023-07-21 CN disclosed
CN-114743800-B Preparation method of polyacrylic acid/graphene-based flexible electrode material 武夷学院 2023-07-21 CN disclosed
CN-113105351-B Electric polarization particle, preparation method thereof and application thereof in electric polarization color-changing optical film 绍兴迪飞新材料有限公司 2023-02-28 CN disclosed
CN-114743800-A Preparation method of polyacrylic acid/graphene-based flexible electrode material 武夷学院 2022-07-12 CN disclosed
CN-114743800-A Preparation method of polyacrylic acid/graphene-based flexible electrode material 武夷学院 2022-07-12 CN disclosed
US-5324747-A Treatment of inflammatory diseases HOFFMANN-LA ROCHE INC. (US) 1994-06-28 US disclosed
WO-1993020160-A1 A METHOD AND LIQUID COMPOSITION FOR THE PRODUCTION OF INDELIBLE SCRIPT ON A PAPER SUBSTRATE SEGALLA GABRIELE (IT) 1993-10-14 WO disclosed
US-4985427-A LIPOXYGENASE INHIBITORS GLAXO GROUP LIMITED (GB) 1991-01-15 US disclosed
EP-0340030-A2 Triazine derivatives GLAXO GROUP LIMITED (GB) 1989-11-02 EP disclosed
US-4459227-A Para-hydroxyphenylhydrazines as in situ precursors of iminoquinones and quinones DUKE UNIVERSITY (US) 1984-07-10 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-20110288003-A1 AMIDE BASED GLUCAGON AND SUPERFAMILY PEPTIDE PRODRUGS GCG, GLP1R, IAPP NPSR1 957/4885ALDH1A1 2679/4885KMT2A 2871/4885

“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.