SCHEMBL48069

SCHEMBL48069

O=C(O)Oc1ccc([N+](=O)[O-])cc1Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 3/20 0.49
CYP11B1 P15538 2/20 0.49
CYP11B2 P19099 2/20 0.49
MAPT P10636 5/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
GAA P10253 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
CRHBP P24387 1/20 0.48
HTT P42858 1/20 0.48
CRHR2 Q13324 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.47
ALDH1A1 P00352 5/20 0.46
TAAR1 Q96RJ0 1/20 0.46
LMNA P02545 1/20 0.45
ITGA4 P13612 1/20 0.44
ITGB7 P26010 1/20 0.44
TP53 P04637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL48068 1.00 CYP19A1 (0.49) CYP19A1CYP11B1CYP11B2MAPTMEN1
SCHEMBL10633557 0.92 PTGDR2 (0.49) CYP19A1CYP11B1CYP11B2MAPTMEN1
SCHEMBL48067 0.92 CYP19A1 (0.49) CYP19A1CYP11B1CYP11B2MAPTMEN1
SCHEMBL11110381 0.89 RECQL (0.53) CYP19A1CYP11B1CYP11B2MAPTMEN1
SCHEMBL7414457 0.88 CYP19A1 (0.55) CYP19A1CYP11B1CYP11B2MAPTMEN1
SCHEMBL6595337 0.88 ALDH1A1 (0.45) CYP19A1CYP11B1CYP11B2MAPTMEN1
SCHEMBL6595335 0.88 ALDH1A1 (0.45) CYP19A1CYP11B1CYP11B2MAPTMEN1
SCHEMBL29570634 0.88 MITF (0.45) CYP19A1CYP11B1CYP11B2MAPTMEN1
SCHEMBL7415724 0.88 CYP19A1 (0.55) CYP19A1CYP11B1CYP11B2MAPTMEN1
SCHEMBL27576402 0.87 CYP19A1 (0.47) CYP19A1MAPTMEN1KMT2AGAA

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025036307-A1 APPLICATION OF ANTI-FRα ANTIBODY-DRUG CONJUGATE IN TREATMENT OF DISEASES 百奥泰生物制药股份有限公司 2025-02-20 WO disclosed
CN-114957053-B Oxoethylene compound or pharmaceutically acceptable salt thereof, preparation method and application thereof, pharmaceutical composition and application thereof 中国医学科学院医药生物技术研究所 2023-12-22 CN disclosed
WO-2023155808-A1 CONJUGATE OF ANTIBODY-ERIBULIN OR DERIVATIVE THEREOF, INTERMEDIATE THEREOF, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF 苏州宜联生物医药有限公司 2023-08-24 WO disclosed
CN-114957053-A Oxoethylene compound or pharmaceutically acceptable salt thereof, preparation method and application thereof, pharmaceutical composition and application thereof 中国医学科学院医药生物技术研究所 2022-08-30 CN disclosed
EP-2149586-B1 AMINE EPOXY RESIN CURING AGENT, GAS BARRIER EPOXY RESIN COMPOSITION COMPRISING THE CURING AGENT, COATING AGENT, AND ADHESIVE AGENT FOR LAMINATE MITSUBISHI GAS CHEMICAL CO (JP) 2018-01-03 EP disclosed
US-8128782-B2 Amine epoxy resin curing agent, gas barrier epoxy resin composition comprising the curing agent, coating agent, and adhesive agent for laminate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-03-06 US disclosed
US-20100160494-A1 AMINE EPOXY RESIN CURING AGENT, GAS BARRIER EPOXY RESIN COMPOSITION COMPRISING THE CURING AGENT, COATING AGENT, AND ADHESIVE AGENT FOR LAMINATE MITSUBISHI GAS CHEMICAL COMPANY INC. (JP) 2010-06-24 US disclosed
EP-2149586-A1 AMINE EPOXY RESIN CURING AGENT, GAS BARRIER EPOXY RESIN COMPOSITION COMPRISING THE CURING AGENT, COATING AGENT, AND ADHESIVE AGENT FOR LAMINATE Mitsubishi Gas Chemical Company, Inc. (JP) 2010-02-03 EP disclosed
US-6815542-B2 Nucleoside compounds and uses thereof RIBAPHARM, INC. 2004-11-09 US disclosed
US-20040002596-A1 Nucleoside compounds and uses thereof TECHNOLAS PERFECT VISION GMBH (DE) 2004-01-01 US disclosed
US-6649652-B2 Hypotensive agents; hyperglycemic agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2003-11-18 US disclosed
US-20030092755-A1 Novel prodrugs for antimicrobial amidines NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-05-15 US disclosed
US-5854212-A Cyclohexapeptidyl bisamine compound, compositions containing said compound and methods of use MERCK & CO., INC. (US) 1998-12-29 US disclosed
EP-0862579-A1 CYCLOHEXAPEPTIDYL BISAMINE COMPOUND, COMPOSITIONS CONTAINING SAID COMPOUND AND METHODS OF USE Merck & Co., Inc. (US) 1998-09-09 EP disclosed
WO-1997017365-A1 CYCLOHEXAPEPTIDYL BISAMINE COMPOUND, COMPOSITIONS CONTAINING SAID COMPOUND AND METHODS OF USE MERCK & CO., INC. (US) 1997-05-15 WO disclosed
US-4125706-A Novel process for the preparation of 1-N-(alpha-substituted-omega-aminoacyl)-3'-deoxyribostamycin ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1978-11-14 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 (2 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-20040002596-A1 Nucleoside compounds and uses thereof PNP, SLC29A1, SLC29A2 CYP19A1 3087/4885CYP11B1 2339/4885CYP11B2 2139/4885
US-20030092755-A1 Novel prodrugs for antimicrobial amidines NR1H3, APEH, NR1H2 CYP19A1 1346/4885CYP11B1 1144/4885CYP11B2 1156/4885

“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.