SCHEMBL3317059

SCHEMBL3317059

COC(=O)C(N)Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.62
MMP2 P08253 2/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
LMNA P02545 1/20 0.48
DPP4 P27487 2/20 0.46
DPP7 Q9UHL4 2/20 0.46
DPP8 Q6V1X1 1/20 0.46
DPP9 Q86TI2 1/20 0.46
IDO1 P14902 2/20 0.46
LOXL2 Q9Y4K0 1/20 0.46
NPC1 O15118 2/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAOB P27338 1/20 0.46
MC4R P32245 1/20 0.46
GAA P10253 1/20 0.45
MAPK1 P28482 1/20 0.45
FAP Q12884 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
SCHEMBL240405 1.00 ALDH1A1 (0.62) ALDH1A1MMP2MEN1KMT2ALMNA
SCHEMBL4367409 1.00 ALDH1A1 (0.62) ALDH1A1MMP2MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL4371678 0.98 ALDH1A1 (0.64) ALDH1A1MMP2MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL1230535 0.98 ALDH1A1 (0.64) ALDH1A1MMP2MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL240404 0.98 ALDH1A1 (0.64) ALDH1A1MMP2MEN1KMT2ALMNA
SCHEMBL27546222 0.98 ALDH1A1 (0.61) ALDH1A1MMP2MEN1KMT2ALMNA
SCHEMBL8211198 0.93 ALDH1A1 (0.56) ALDH1A1MMP2MEN1KMT2ADPP4
SCHEMBL4097192 0.93 ALDH1A1 (0.56) ALDH1A1MMP2MEN1KMT2ADPP4
SCHEMBL11651148 0.88 MMP2 (0.49) ALDH1A1MMP2LMNADPP4DPP7
SCHEMBL1859542 0.87 MAPT (0.50) ALDH1A1MMP2LMNADPP4DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260001924-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME NEW YORK UNIVERSITY (US) 2026-01-01 US disclosed
US-12371461-B2 Nemo coiled coil mimics and methods of using same NEW YORK UNIVERSITY (US) 2025-07-29 US disclosed
EP-4541378-A2 COMPOUNDS FOR POSITRON EMISSION TOMOGRAPHY Endocyte, Inc. (US) 2025-04-23 EP disclosed
EP-3777898-B1 COMPOUNDS FOR POSITRON EMISSION TOMOGRAPHY ENDOCYTE INC (US) 2025-01-01 EP disclosed
US-12178892-B2 Compounds for positron emission tomography PURDUE RESEARCH FOUNDATION (US) 2024-12-31 US disclosed
WO-2024145483-A1 COMPOUNDS FOR USE IN THE TREATMENT OF CANCER AND METHODS OF MAKING AND USING THE SAME HTG MOLECULAR DIAGNOSTICS, INC. (US) 2024-07-04 WO disclosed
US-20240190930-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME UNIV NEW YORK (US) 2024-06-13 US disclosed
WO-2024097355-A1 DEUBIQUITINASE-TARGETING CHIMERAS AND RELATED METHODS VICINITAS THERAPEUTICS, INC. (US) 2024-05-10 WO disclosed
US-11891422-B2 NEMO coiled coil mimics and methods of using same NEW YORK UNIVERSITY (US) 2024-02-06 US disclosed
US-20240025846-A1 ULTRA SHORT ACTING ANTI-ARRHYTHMIC AGENTS ACAD PHARMACEUTICALS INC (US) 2024-01-25 US disclosed
EP-0484989-B1 Polysubstituted diethylenetriamine chelates for forming a metal-chelate-protein conjugate GANSOW OTTO A (US) 1996-04-24 EP disclosed
EP-0587134-A2 Cyclic urea derivatives, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1994-03-16 EP disclosed
WO-1994003593-A1 AMPLIFIER MOLECULES FOR ENHANCEMENT OF DIAGNOSIS AND THERAPY THE STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF OREGON (US) 1994-02-17 WO disclosed
EP-0328529-B1 METHOD FOR PREPARING POLYSUBSTITUTED DIETHYLENETRIAMINEPENTAACETIC ACIDS GANSOW OTTO A (US) 1994-01-26 EP disclosed
US-5246692-A Diagnostic, theraputic THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF HEALTH AND HUMAN SERVICES (US) 1993-09-21 US disclosed
EP-0529645-A1 Process for the preparation of backbone polysubstituted chelates. GANSOW, Otto A. (US) 1993-03-03 EP disclosed
EP-0484989-A1 Polysubstituted diethylenetriamine chelates for forming a metal-chelate-protein conjugate GANSOW, Otto A. (US) 1992-05-13 EP disclosed
US-5099069-A Radioactive materials for diagnosis and treatment of tumors and cancer by joining monoclonal antibodies GANSOW OTTO A (US) 1992-03-24 US disclosed
US-4831175-A Backbone polysubstituted chelates for forming a metal chelate-protein conjugate THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1989-05-16 US disclosed
US-4622420-A Chelating agents and method THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1986-11-11 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 (6 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-12371461-B2 Nemo coiled coil mimics and methods of using same COIL, CALCOCO2, NCAPH ALDH1A1 3890/4885MMP2 4776/4885MEN1 200/4885
US-20240025846-A1 ULTRA SHORT ACTING ANTI-ARRHYTHMIC AGENTS CACNA1G, SCN5A, CACNA1F ALDH1A1 1515/4885MMP2 4140/4885MEN1 4508/4885
US-12178892-B2 Compounds for positron emission tomography FOLH1, FOLR2, FOLR1 ALDH1A1 2485/4885MMP2 3053/4885MEN1 259/4885
US-20260001924-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME DDX21, PHAX, RBX1 ALDH1A1 4748/4885MMP2 4688/4885MEN1 2283/4885
US-11891422-B2 NEMO coiled coil mimics and methods of using same COIL, CALCOCO2, NCAPH ALDH1A1 3890/4885MMP2 4776/4885MEN1 200/4885
US-20240190930-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME COIL, CALCOCO2, NCAPH ALDH1A1 3702/4885MMP2 4799/4885MEN1 144/4885

“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.