SCHEMBL1177730

SCHEMBL1177730

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 1.00
KMT2A Q03164 8/20 1.00
NPC1 O15118 5/20 0.79
MAPT P10636 4/20 0.79
RAB9A P51151 4/20 0.79
MAPK1 P28482 3/20 0.79
NPSR1 Q6W5P4 1/20 0.79
MYOC Q99972 1/20 0.79
LMNA P02545 2/20 0.77
SMN1; SMN2 Q16637 2/20 0.77
CA12 O43570 1/20 0.66
CA1 P00915 1/20 0.66
CA2 P00918 1/20 0.66
CA9 Q16790 1/20 0.66
PTGES O14684 1/20 0.65
TGM2 P21980 1/20 0.65
POLB P06746 2/20 0.64
APEX1 P27695 1/20 0.64
EPHX1 P07099 1/20 0.63
NAMPT P43490 1/20 0.62

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
SCHEMBL6302157 1.00 MEN1 (1.00) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL6302417 0.94 MEN1 (0.89) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL11055960 0.92 MEN1 (0.85) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL18825691 0.91 MEN1 (0.82) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL4115432 0.91 MEN1 (0.82) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL1311708 0.91 MEN1 (0.82) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL16005844 0.90 MEN1 (0.81) MEN1KMT2ANPC1MAPTRAB9A
Diphenylurea SCHEMBL27302793 0.90 MEN1 (0.81) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL6939392 0.89 MEN1 (0.79) MEN1KMT2ANPC1MAPTRAB9A
SCHEMBL3460442 0.89 MEN1 (0.79) MEN1KMT2ANPC1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114671783-A Preparation method of 4, 4' -dinitro diphenyl urea 浙江工业大学 2022-06-28 CN claimed
US-20080221214-A1 Process for the preparation of \"Urchym\" a urease and alpha-chymotrypsin enzyme inhibitory drug PERVEEN SHAHNAZ 2008-09-11 US claimed
WO-2006060774-A2 AGENTS THAT INHIBIT FLAVIVIRUS REPLICATION AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-06-08 WO claimed
US-6465194-B2 HYBRIDOMA CELL LINE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE 2002-10-15 US claimed
US-20010039332-A1 Monoclonal antibodies to 4,4'-dinitrocarbanilide and a method for analyzing for the drug nicarbazin AGRICULTURE, UNITED STATES OF AMERICA, THE, AS REPRESENTED BY THE SECRETARY 2001-11-08 US claimed
US-5552386-A COMPOUNDS FOR BACTERICIDES OR ANTIPROTOZOA AGENTS ELI LILLY AND COMPANY (US) 1996-09-03 US claimed
EP-0341019-B1 POLYETHER ANTIBIOTIC ELI LILLY AND COMPANY (US) 1993-01-13 EP claimed
EP-0184291-B1 POLYETHER ANTIBIOTIC A80190 ELI LILLY AND COMPANY (US) 1992-05-27 EP claimed
EP-0422818-A1 New polyether antibiotic ELI LILLY AND COMPANY (US) 1991-04-17 EP claimed
EP-0209971-B1 POLYETHER ANTIBIOTIC AND PROCESS FOR ITS PRODUCTION ELI LILLY AND COMPANY (US) 1991-03-06 EP claimed
EP-0341019-A2 Polyether antibiotic ELI LILLY AND COMPANY (US) 1989-11-08 EP claimed
US-4824863-A POLYETHER ANTIBIOTIC, FEEDS ELI LILLY AND COMPANY (US) 1989-04-25 US claimed
EP-0209971-A1 Polyether antibiotic and process for its production ELI LILLY AND COMPANY (US) 1987-01-28 EP claimed
EP-0184291-A2 Polyether antibiotic A80190 ELI LILLY AND COMPANY (US) 1986-06-11 EP claimed
US-4582822-A ANIMAL FEED ADDITIVES ELI LILLY AND COMPANY (US) 1986-04-15 US claimed
US-4218438-A POULTRY FEED ELI LILLY AND COMPANY (US) 1980-08-19 US claimed
US-3957997-A Anticoccidial complexes of 4,4'-dinitrocarbanilides MERCK & CO., INC. (US) 1976-05-18 US claimed
US-12606923-B2 Acid-free pyrolytic synthesis of M-N-C catalyst THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2026-04-21 US disclosed
US-3957997-A Anticoccidial complexes of 4,4'-dinitrocarbanilides MERCK & CO., INC. (US) 1976-05-18 US disclosed
US-3926935-A Anticoccidial complexes MERCK & CO INC 1975-12-16 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-20010039332-A1 Monoclonal antibodies to 4,4'-dinitrocarbanilide and a method for analyzing for the drug nicarbazin NRDC, NDC1, NFATC1 MEN1 2005/4885KMT2A 3023/4885NPC1 2882/4885
US-12606923-B2 Acid-free pyrolytic synthesis of M-N-C catalyst LMNA, MNS1, FLNB MEN1 12/4885KMT2A 2118/4885NPC1 1418/4885

“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.