SCHEMBL441296

SCHEMBL441296

Nc1ccc(C(=O)O)cc1[N+](=O)[O-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 1.00
CASP6 P55212 1/20 0.70
TSHR P16473 3/20 0.64
HCAR3 P49019 7/20 0.58
TDP1 Q9NUW8 4/20 0.58
MEN1 O00255 2/20 0.58
MAPT P10636 2/20 0.58
KMT2A Q03164 2/20 0.58
POLB P06746 1/20 0.58
ALDH1A1 P00352 1/20 0.58
CYP3A4 P08684 1/20 0.58
ALOX15 P16050 1/20 0.58
APEX1 P27695 1/20 0.54

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
SCHEMBL1162258 1.00 LMNA (1.00) LMNACASP6TSHRHCAR3TDP1
SCHEMBL3392676 0.93 LMNA (0.87) LMNACASP6TSHRHCAR3TDP1
1,5-Pentanediol SCHEMBL8846459 0.89 LMNA (0.79) LMNACASP6TSHRHCAR3TDP1
SCHEMBL31174170 0.87 LMNA (0.77) LMNACASP6TSHRTDP1MEN1
SCHEMBL865520 0.87 LMNA (0.77) LMNACASP6TSHRTDP1MEN1
SCHEMBL1607853 0.85 LMNA (0.74) LMNACASP6TSHRHCAR3TDP1
SCHEMBL1470130 0.85 LMNA (0.74) LMNACASP6TSHRTDP1MEN1
SCHEMBL10532614 0.84 LMNA (0.71) LMNAHCAR3MEN1MAPTKMT2A
SCHEMBL27717235 0.84 LMNA (0.71) LMNACASP6TSHRHCAR3TDP1
SCHEMBL263311 0.84 LMNA (0.72) LMNATSHRTDP1MEN1MAPT

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 1116 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118880486-B Cool polyester fiber and preparation method thereof 江苏恒科新材料有限公司 2025-06-24 CN claimed
CN-120114456-A Pyruvate-based composition for treating pneumonia and preparation method thereof 江苏长泰药业股份有限公司 2025-06-10 CN claimed
CN-115584102-B Creep-resistant insulating engineering plastic and preparation method thereof 丁克锋 2024-11-15 CN claimed
CN-118880486-A Cool polyester fiber and preparation method thereof 江苏恒科新材料有限公司 2024-11-01 CN claimed
CN-118440680-B Corrosion inhibitor for high-temperature-resistant acidification and preparation method thereof 寿光新海能源技术有限公司 2024-10-22 CN claimed
CN-118440680-A Corrosion inhibitor for high-temperature-resistant acidification and preparation method thereof 寿光新海能源技术有限公司 2024-08-06 CN claimed
CN-118405988-A Novel ferrostatin-1 analogue, preparation method and application 大连理工大学 2024-07-30 CN claimed
CN-114080383-B Process for preparing indole or indazole compounds 株式会社LG化学 2024-07-23 CN claimed
CN-118359893-A Preparation method of creep-resistant insulating engineering plastic 丁克锋 2024-07-19 CN claimed
CN-117164855-A High-cohesiveness branched polyimide polymer and preparation method thereof 江苏环峰电工材料有限公司 2023-12-05 CN claimed
CN-1738650-A Improved gastrin releasing peptide compounds BRACCO IMAGING SPA (IT) 2006-02-22 CN claimed
US-20060018830-A1 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2006-01-26 US claimed
EP-1585549-A2 IMPROVED GASTRIN RELEASING PEPTIDE COMPOUNDS Bracco Imaging S.p.A. (IT) 2005-10-19 EP claimed
US-20040253225-A1 bombesin, derivatives and/or analogues capable of complexing metal ions, radionuclides or optical labels, for use in radiotherapy BRACCO IMAGING S.P.A. (IT) 2004-12-16 US claimed
WO-2004065407-A2 IMPROVED GASTRIN RELEASING PEPTIDE COMPOUNDS BRACCO IMAGING S.P.A. (IT) 2004-08-05 WO claimed
US-20040136906-A1 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2004-07-15 US claimed
WO-2002095393-A2 DRUG EVOLUTION: DRUG DESIGN AT HOT SPOTS NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2002-11-28 WO claimed
EP-0429614-B1 AZOPHENYL COMPOUNDS JAMES ROBINSON LTD (GB) 1995-10-11 EP claimed
EP-0429614-A1 AZOPHENYL COMPOUNDS. JAMES ROBINSON LTD (GB) 1991-06-05 EP claimed
WO-1990015850-A1 AZOPHENYL COMPOUNDS JAMES ROBINSON LIMITED (GB) 1990-12-27 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 (3 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-20040253225-A1 bombesin, derivatives and/or analogues capable of complexing metal ions, radionuclides or optical labels, for use in radiotherapy GRPR, MLNR, NPBWR1 LMNA 1801/4885CASP6 3528/4885TSHR 160/4885
US-20060018830-A1 Gastrin releasing peptide compounds GRPR, GIPR, CCKBR LMNA 4181/4885CASP6 2598/4885TSHR 136/4885
US-20040136906-A1 Gastrin releasing peptide compounds GRPR, GIPR, MLNR LMNA 3400/4885CASP6 3785/4885TSHR 136/4885

“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.