SCHEMBL24606

SCHEMBL24606

O=C(OCCl)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.57
BCL9 O00512 1/20 0.54
CTNNB1 P35222 1/20 0.54
GAA P10253 1/20 0.53
PTPN7 P35236 1/20 0.49
PTPN12 Q05209 1/20 0.49
PTPN22 Q9Y2R2 1/20 0.49
PKM P14618 1/20 0.49
KMT2A Q03164 1/20 0.49
MGLL Q99685 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 2/20 0.46
ALDH1A1 P00352 2/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45

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
SCHEMBL7477346 0.87 HTR2A (0.54) HTR2ABCL9CTNNB1GAAPTPN7
SCHEMBL409598 0.86 HTR2A (0.59) HTR2ABCL9CTNNB1GAAPTPN7
SCHEMBL5526504 0.85 HTR2A (0.58) HTR2ABCL9CTNNB1GAAPTPN7
SCHEMBL20466168 0.84 HTR2A (0.52) HTR2ABCL9CTNNB1GAAPTPN7
SCHEMBL12064910 0.84 HTR2A (0.52) HTR2ABCL9CTNNB1GAAPTPN7
SCHEMBL26374 0.84 GAA (0.65) HTR2ABCL9CTNNB1GAAPKM
SCHEMBL25764 0.83 HTR2A (0.57) HTR2ABCL9CTNNB1GAAPTPN7
SCHEMBL763025 0.83 HTR2A (0.57) HTR2ABCL9CTNNB1GAAPTPN7
SCHEMBL13069276 0.83 HTR2A (0.57) HTR2ABCL9CTNNB1GAAPTPN7
SCHEMBL1421471 0.83 HTR2A (0.57) HTR2ABCL9CTNNB1GAAPTPN7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4294813-B1 TETRACYCLIC HETEROCYCLE COMPOUNDS USEFUL AS HIV INTEGRASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2025-09-10 EP disclosed
US-20250214931-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS Cadrenal Therapeutics, Inc. 2025-07-03 US disclosed
US-20250144230-A1 LINKERS FOR USE IN ANTIBODY DRUG CONJUGATES ORUM THERAPEUTICS, INC. (KR) 2025-05-08 US disclosed
WO-2025080689-A1 LIPID PRODRUGS OF BROMOLYSERGIDE AND USES THEREOF SEAPORT THERAPEUTICS, INC. (US) 2025-04-17 WO disclosed
CN-119522222-A Nitrogen-containing heterocyclic compound, preparation method thereof, intermediate thereof and application thereof 上海艾力斯医药科技股份有限公司 2025-02-25 CN disclosed
EP-4509184-A2 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas Operations, Inc. (US) 2025-02-19 EP disclosed
US-20250034096-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2025-01-30 US disclosed
EP-3526202-B1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS INC (US) 2025-01-08 EP disclosed
WO-2024238872-A2 ISOINDOLINONE-GLUTARIMIDE ANTIBODY CONJUGATES, AND USES THEREOF FIREFLY BIO, INC. (US) 2024-11-21 WO disclosed
US-12084414-B2 Therapeutic compounds and compositions EXITHERA PHARMACEUTICALS, INC. (US) 2024-09-10 US disclosed
WO-2002100347-A2 PRODRUGS OF GABA ANALOGS, COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2002-12-19 WO disclosed
US-20020151529-A1 Bile-acid derived compounds for providing sustained systemic concentrations of drugs after oral administration XENOPORT, INC. 2002-10-17 US disclosed
WO-2002028881-A1 BILE-ACID DERIVED COMPOUNDS FOR PROVIDING SUSTAINED SYSTEMIC CONCENTRATIONS OF DRUGS AFTER ORAL ADMINISTRATION XENOPORT, INC. (US) 2002-04-11 WO disclosed
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed
EP-0830372-A1 CYCLIC PRODRUGS OF PEPTIDES AND PEPTIDE NUCLEIC ACIDS HAVING IMPROVED METABOLIC STABILITY AND CELL MEMBRANE PERMEABILITY THE UNIVERSITY OF KANSAS (US) 1998-03-25 EP disclosed
WO-1997039024-A1 CYCLIC PRODRUGS OF PEPTIDES AND PEPTIDE NUCLEIC ACIDS HAVING IMPROVED METABOLIC STABILITY AND CELL MEMBRANE PERMEABILITY THE UNIVERSITY OF KANSAS (US) 1997-10-23 WO disclosed
EP-0167451-B1 A NEW PROCESS FOR PREPARING NOVEL N-(ACYLOXY-ALKOXY) CARBONYL DERIVATIVES USEFUL AS BIOREVERSIBLE PRODRUG MOIETIES FOR PRIMARY AND SECONDARY AMINE FUNCTIONS IN DRUGS MERCK & CO. INC. (US) 1990-10-03 EP disclosed
US-4916230-A Process for preparing novel N-(acyloxy-alkoxy)carbonyl derivatives useful as bioreversible prodrug moieties for primary and secondary amine functions in drugs MERCK & CO., INC. (US) 1990-04-10 US disclosed
EP-0167451-A2 A new process for preparing novel N-(acyloxy-alkoxy) carbonyl derivatives useful as bioreversible prodrug moieties for primary and secondary amine functions in drugs MERCK & CO. INC. (US) 1986-01-08 EP 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 (5 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-20020151529-A1 Bile-acid derived compounds for providing sustained systemic concentrations of drugs after oral administration SLC10A2, SLC10A1, ABCB11 HTR2A 2906/4885BCL9 2071/4885CTNNB1 3882/4885
US-12084414-B2 Therapeutic compounds and compositions KLK5, KLKB1, KLK2 HTR2A 4104/4885BCL9 2071/4885CTNNB1 3511/4885
US-20250034096-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN HTR2A 1200/4885BCL9 1369/4885CTNNB1 1742/4885
US-20250144230-A1 LINKERS FOR USE IN ANTIBODY DRUG CONJUGATES CD2BP2, CD47, EPCAM HTR2A 4235/4885BCL9 30/4885CTNNB1 4513/4885
US-20250214931-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS KLK5, KLKB1, KLK2 HTR2A 4104/4885BCL9 2071/4885CTNNB1 3511/4885

“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.