SCHEMBL185472

SCHEMBL185472

NC(CC(=O)O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.68
TSHR P16473 2/20 0.68
ALDH1A1 P00352 3/20 0.49
CTSD P07339 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP26A1 O43174 1/20 0.43
HSD17B10 Q99714 1/20 0.42
GRM8 O00222 1/20 0.41
GRM4 Q14833 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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 SCHEMBL3818322 0.98 CYP1A2 (0.66) CYP1A2TSHRALDH1A1CTSDL3MBTL1
SCHEMBL258598 0.82 CYP1A2 (0.69) CYP1A2TSHRALDH1A1CTSDL3MBTL1
SCHEMBL5853954 0.82 ALDH1A1 (0.58) CYP1A2TSHRALDH1A1CTSDMAPT
SCHEMBL3051206 0.81 CYP1A2 (0.68) CYP1A2TSHRALDH1A1CTSDL3MBTL1
SCHEMBL7263686 0.81 CYP1A2 (1.00) CYP1A2TSHRALDH1A1CTSDL3MBTL1
SCHEMBL5583414 0.81 CYP1A2 (0.68) CYP1A2TSHRALDH1A1CTSDL3MBTL1
SCHEMBL7263695 0.81 CYP1A2 (1.00) CYP1A2TSHRALDH1A1CTSDL3MBTL1
SCHEMBL3259894 0.81 CYP1A2 (0.68) CYP1A2TSHRALDH1A1CTSDL3MBTL1
SCHEMBL10616251 0.80 CYP1A2 (0.54) CYP1A2TSHRALDH1A1MAPTGRM8
SCHEMBL1471179 0.80 CYP1A2 (0.49) CYP1A2TSHRALDH1A1CTSDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250354931-A1 SPATIAL TARGETING OF ANALYTES 10X GENOMICS INC (US) 2025-11-20 US claimed
US-12399123-B1 Spatial targeting of analytes 10X GENOMICS, INC. (US) 2025-08-26 US claimed
US-20250205372-A1 RADIOPHARMACEUTICAL COMPOSITIONS, SYNTHETIC METHODS, AND METHODS OF TREATMENT THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2025-06-26 US claimed
CN-118019980-A Peptide screening 牛津大学科技创新有限公司 2024-05-10 CN claimed
EP-4348255-A1 PEPTIDE SCREEN Oxford University Innovation Limited (GB) 2024-04-10 EP claimed
CN-117487028-A Polypeptide for increasing antigen to tumor tissue and application thereof 南开大学 2024-02-02 CN claimed
US-20230390335-A1 SYNTHETIC ANTIGENS AS CHIMERIC ANTIGEN RECEPTOR (CAR) LIGANDS AND USES THEREOF GEORGIA TECH RESEARCH CORPORATION 2023-12-07 US claimed
WO-2023178313-A2 RADIOPHARMACEUTICAL COMPOSITIONS, SYNTHETIC METHODS, AND METHODS OF TREATMENT THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2023-09-21 WO claimed
EP-4204445-A2 ASSAYS AND REAGENTS FOR CHARACTERIZATION OF MHCI PEPTIDE BINDING GENENTECH, INC. (US) 2023-07-05 EP claimed
CN-116234813-A Assays and reagents for characterizing MHCI peptide binding 基因泰克公司 2023-06-06 CN claimed
US-20170145060-A9 MEANS AND METHODS FOR BREAKING NONCOVALENT BINDING INTERACTIONS BETWEEN MOLECULES HET NEDERLANDS KANKER INSTITUUT (NL) 2017-05-25 US claimed
US-20150246952-A1 MEANS AND METHODS FOR BREAKING NONCOVALENT BINDING INTERACTIONS BETWEEN MOLECULES HET NL KANKER INST (NL) 2015-09-03 US claimed
US-9079941-B2 Means and methods for breaking noncovalent binding interactions between molecules HET NEDERLANDS KANKER INSTITUUT (NL) 2015-07-14 US claimed
CN-101146824-B Means and methods for breaking non-covalent binding interactions between molecules HET NL KANKER I 2013-06-19 CN claimed
EP-1841791-B1 MEANS AND METHODS FOR BREAKING NONCOVALENT BINDING INTERACTIONS BETWEEN MOLECULES STICHTING NL KANKER INST (NL) 2012-12-19 EP claimed
US-20080145378-A1 Means and Methods for Breaking Noncovalent Binding Interactions Between Molecules HET NEDERLANDS KANKER INSTITUUT (NL) 2008-06-19 US claimed
CN-101146824-A Means and methods for breaking non-covalent binding interactions between molecules HET NL KANKER I (NL) 2008-03-19 CN claimed
EP-1841791-A2 MEANS AND METHODS FOR BREAKING NONCOVALENT BINDING INTERACTIONS BETWEEN MOLECULES Het Nederlands Kanker Instituut (NL) 2007-10-10 EP claimed
WO-2006080837-A2 MEANS AND METHODS FOR BREAKING NONCOVALENT BINDING INTERACTIONS BETWEEN MOLECULES HET NEDERLANDS KANKER INSTITUUT (NL) 2006-08-03 WO claimed
EP-1683808-A1 Means and methods for breaking noncovalent binding interactions between molecules Het Nederlands Kanker Instituut (NL) 2006-07-26 EP 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 (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-20250205372-A1 RADIOPHARMACEUTICAL COMPOSITIONS, SYNTHETIC METHODS, AND METHODS OF TREATMENT QPCT, SSTR5, SSTR4 CYP1A2 1225/4885TSHR 84/4885ALDH1A1 3744/4885

“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.