SCHEMBL6794151

SCHEMBL6794151

O=C(O)/C=C\C(=O)Nc1cccc([N+](=O)[O-])c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.73
KMT2A Q03164 4/20 0.73
MAPT P10636 4/20 0.73
ALDH1A1 P00352 3/20 0.73
HSP90AA1 P07900 2/20 0.73
HPGD P15428 2/20 0.73
NPSR1 Q6W5P4 2/20 0.73
MAPK1 P28482 1/20 0.73
CACNA1B Q00975 1/20 0.73
APBA1 Q02410 1/20 0.73
NLRP1 Q9C000 1/20 0.73
LPAR1 Q92633 1/20 0.69
LPAR2 Q9HBW0 1/20 0.69
NPC1 O15118 1/20 0.67
PKM P14618 1/20 0.67
CCR6 P51684 1/20 0.67
APOBEC3G Q9HC16 1/20 0.67
POLB P06746 2/20 0.65
DDX3X O00571 1/20 0.65
HTT P42858 1/20 0.65

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
SCHEMBL6794156 1.00 MEN1 (0.73) MEN1KMT2AMAPTALDH1A1HSP90AA1
SCHEMBL23547197 0.85 TRPV1 (0.73) MEN1KMT2AMAPTALDH1A1HSP90AA1
SCHEMBL6754378 0.85 TRPV1 (0.73) MEN1KMT2AMAPTALDH1A1HSP90AA1
SCHEMBL6754380 0.85 TRPV1 (0.73) MEN1KMT2AMAPTALDH1A1HSP90AA1
SCHEMBL27746161 0.83 KMT2A (0.66) MEN1KMT2AMAPTALDH1A1HSP90AA1
SCHEMBL441804 0.82 LPAR2 (1.00) MEN1KMT2AMAPTALDH1A1LPAR1
SCHEMBL441805 0.82 LPAR2 (1.00) MEN1KMT2AMAPTALDH1A1LPAR1
SCHEMBL1552033 0.82 LPAR2 (1.00) MEN1KMT2AMAPTALDH1A1LPAR1
SCHEMBL5149342 0.82 KMT2A (0.69) MEN1KMT2AMAPTALDH1A1HSP90AA1
SCHEMBL468012 0.82 KMT2A (0.68) MEN1KMT2AMAPTALDH1A1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0403240-B1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS (JP) 1994-08-24 EP claimed
EP-0372922-B1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS (JP) 1994-03-09 EP claimed
US-5175309-A Forming an imide by heat catalytic dehydration MITSUI TOATSU CHEMICALS INC. (JP) 1992-12-29 US claimed
US-5068357-A Heat dehydration of an N-substituted maleamic acid with a solvent, distillation after imidation, in the presence of a tin catalyst MITSUI TOATSU CHEMICALS, INC. (JP) 1991-11-26 US claimed
EP-0403240-A1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-12-19 EP claimed
EP-0372922-A2 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-06-13 EP claimed
US-6727245-B2 4-(HETERO)ARYL-3-OXO-3,4-DIHYDROPYRIDO(2,3-B)PYRAZINE DERIVATIVES; PROPHYLACTIC OR THERAPEUTIC TREATMENT OF PHOSPHODIESTERASE IV AND TUMOR NECROSIS FACTOR MEDIATED DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-04-27 US disclosed
EP-0770079-B1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-02-12 EP disclosed
US-20020107251-A1 Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-08-08 US disclosed
US-6426345-B1 PHOSPHODIESTERASE INHIBITORS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-30 US disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
EP-0920867-A1 Pyrido[2,3-a]pyrazine derivatives as PDE-IV and TNF inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-06-09 EP disclosed
WO-1996001825-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-01-25 WO disclosed
EP-0403240-B1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS (JP) 1994-08-24 EP disclosed
EP-0372922-B1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS (JP) 1994-03-09 EP disclosed
US-5175309-A Forming an imide by heat catalytic dehydration MITSUI TOATSU CHEMICALS INC. (JP) 1992-12-29 US disclosed
US-5068357-A Heat dehydration of an N-substituted maleamic acid with a solvent, distillation after imidation, in the presence of a tin catalyst MITSUI TOATSU CHEMICALS, INC. (JP) 1991-11-26 US disclosed
EP-0403240-A1 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-12-19 EP disclosed
EP-0372922-A2 Preparation process of N-substituted maleimides MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-06-13 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 (1 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-20020107251-A1 Heterobicyclic derivatives ARSA, ARRB1, SULT2A1 MEN1 2703/4885KMT2A 968/4885MAPT 4677/4885

“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.