SCHEMBL1608505

SCHEMBL1608505

N#Cc1ccc([N+](=O)[O-])o1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
L3MBTL1 Q9Y468 5/20 0.44
LMNA P02545 4/20 0.44
KDM4E B2RXH2 4/20 0.44
MEN1 O00255 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 3/20 0.44
NPSR1 Q6W5P4 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MITF O75030 1/20 0.44
XBP1 P17861 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
POLB P06746 4/20 0.40
TLR9 Q9NR96 1/20 0.39
GLO1 Q04760 1/20 0.39
CASP6 P55212 1/20 0.37
VCAM1 P19320 1/20 0.36
HTT P42858 2/20 0.36

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
SCHEMBL1811649 0.81 LMNA (0.46) KMT2AL3MBTL1LMNAKDM4EMEN1
SCHEMBL8537838 0.81 FBP1 (0.39) KMT2AL3MBTL1LMNAKDM4EMEN1
SCHEMBL11848697 0.79 LMNA (0.44) KMT2AL3MBTL1LMNAKDM4EMEN1
SCHEMBL8538501 0.79 LMNA (0.44) KMT2AL3MBTL1LMNAKDM4EMEN1
SCHEMBL15200988 0.77 LMNA (0.58) KMT2AL3MBTL1LMNAKDM4EMEN1
SCHEMBL11731415 0.76 LMNA (0.42) KMT2AL3MBTL1LMNAKDM4EMEN1
SCHEMBL1993729 0.71
SCHEMBL11486200 0.71 MAPT (0.51) KMT2AL3MBTL1LMNAMEN1TDP1
SCHEMBL8646262 0.69 MAPT (0.40) KMT2AL3MBTL1LMNAKDM4EMEN1
SCHEMBL11450439 0.67 KMT2A (0.58) KMT2AL3MBTL1LMNAKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0043598-B1 PROCESS FOR THE TRANSFORMATION OF FURFURAL OR 5-NITRO-FURFURAL INTO FURONITRILE OR 5-NITRO-FURONITRILE AGRIFURANE S.A. (FR) 1984-07-11 EP claimed
US-20250034146-A1 ELECTRO-PHOTOCHEMICAL SYNTHESIS OF 1,2,4-TRIAZOLO-[4,3-A]PYRAZINE PURDUE RESEARCH FOUNDATION (US) 2025-01-30 US disclosed
US-20240317727-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CANCER DUKE UNIVERSITY 2024-09-26 US disclosed
EP-3860994-B1 TRANSCRIPTION FACTOR BRN2 INHIBITORY COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE UNIV BRITISH COLUMBIA (CA) 2024-08-14 EP disclosed
US-20220106304-A1 Transcription Factor BRN2 Inhibitory Compounds as Therapeutics and Methods for Their Use THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2022-04-07 US disclosed
EP-3860994-A1 TRANSCRIPTION FACTOR BRN2 INHIBITORY COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE The University of British Columbia (CA) 2021-08-11 EP disclosed
WO-2020069625-A1 TRANSCRIPTION FACTOR BRN2 INHIBITORY COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2020-04-09 WO disclosed
US-9617249-B2 Benzoheterocyclic anti-bacterial agents UNIVERSITY OF NOTRE DAME DU LAC (US) 2017-04-11 US disclosed
US-20130143841-A1 BENZOHETEROCYCLIC ANTI-BACTERIAL AGENTS UNIVERSITY OF NOTRE DAME DU LAC (US) 2013-06-06 US disclosed
US-8362268-B2 Anti-bacterial agents from benzo[d]heterocyclic scaffolds for prevention and treatment of multidrug resistant bacteria UNIVERSITY OF NOTRE DAME DU LAC (US) 2013-01-29 US disclosed
US-20110086817-A1 ANTI-BACTERIAL AGENTS FROM BENZO[D]HETEROCYCLIC SCAFFOLDS FOR PREVENTION AND TREATMENT OF MULTIDRUG RESISTANT BACTERIA UNIVERSITY OF NOTRE DAME DU LAC (US) 2011-04-14 US disclosed
US-6878705-B2 4-oxo-4,7-dihydrofuro[2,3-b]pyridine-5-carboxamide antiviral agents PFIZER (US) 2005-04-12 US disclosed
US-20040259907-A1 4-OXO-4,7-DIHYDROFURO[2,3-B]PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY 2004-12-23 US disclosed
EP-1465895-A2 4-OXO-4,7-DIHYDROFURO(2,3-B)PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2004-10-13 EP disclosed
WO-2003059911-A2 4-OXO-4, 7-DIHYDROFURO[2,3-b]PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2003-07-24 WO disclosed
EP-0043598-B1 PROCESS FOR THE TRANSFORMATION OF FURFURAL OR 5-NITRO-FURFURAL INTO FURONITRILE OR 5-NITRO-FURONITRILE AGRIFURANE S.A. (FR) 1984-07-11 EP disclosed
EP-0043598-A1 Process for the transformation of furfural or 5-nitro-furfural into furonitrile or 5-nitro-furonitrile AGRIFURANE S.A. (FR) 1982-01-13 EP disclosed
EP-0043598-A1 Process for the transformation of furfural or 5-nitro-furfural into furonitrile or 5-nitro-furonitrile AGRIFURANE S.A. (FR) 1982-01-13 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 (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-20040259907-A1 4-OXO-4,7-DIHYDROFURO[2,3-B]PYRIDINE-5-CARBOXAMIDE ANTIVIRAL AGENTS IL4, ZC3HAV1, IRF3 KMT2A 731/4885L3MBTL1 3764/4885LMNA 4193/4885
US-20220106304-A1 Transcription Factor BRN2 Inhibitory Compounds as Therapeutics and Methods for Their Use BRDT, CBFB, CREBBP KMT2A 428/4885L3MBTL1 533/4885LMNA 227/4885
US-20110086817-A1 ANTI-BACTERIAL AGENTS FROM BENZO[D]HETEROCYCLIC SCAFFOLDS FOR PREVENTION AND TREATMENT OF MULTIDRUG RESISTANT BACTERIA SBDS, PYCARD, AAAS KMT2A 2379/4885L3MBTL1 235/4885LMNA 1073/4885
US-20240317727-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CANCER HSF1, HSP90AB1, HSP90AA1 KMT2A 3139/4885L3MBTL1 2726/4885LMNA 1978/4885
US-20250034146-A1 ELECTRO-PHOTOCHEMICAL SYNTHESIS OF 1,2,4-TRIAZOLO-[4,3-A]PYRAZINE CYP4Z1, TYR, PPOX KMT2A 2735/4885L3MBTL1 4727/4885LMNA 3450/4885
US-20130143841-A1 BENZOHETEROCYCLIC ANTI-BACTERIAL AGENTS MRPL21, BCOR, BCR KMT2A 1565/4885L3MBTL1 143/4885LMNA 1398/4885

“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.