SCHEMBL23811

SCHEMBL23811

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

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.62
MEN1 O00255 6/20 0.62
MAPT P10636 6/20 0.61
POLB P06746 2/20 0.61
ALDH1A1 P00352 2/20 0.61
LMNA P02545 4/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
NPC1 O15118 1/20 0.59
MAPK1 P28482 1/20 0.59
HTT P42858 3/20 0.58
HPGD P15428 1/20 0.58
GAA P10253 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CA4 P22748 1/20 0.57
CA7 P43166 1/20 0.57
HSP90AA1 P07900 1/20 0.56

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
SCHEMBL9018657 0.89 MEN1 (0.71) KMT2AMEN1MAPTPOLBALDH1A1
4-Nitroaniline SCHEMBL11516258 0.85 MAPT (0.56) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL1706183 0.84 KMT2A (0.65) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL3677488 0.84 MEN1 (0.65) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL5343120 0.83 KMT2A (0.64) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL14871553 0.83 KMT2A (0.59) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL593172 0.83 MAPT (0.74) KMT2AMEN1MAPTPOLBALDH1A1
Hydrochloric Acid SCHEMBL4185047 0.83 MEN1 (0.62) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL7741358 0.82 MEN1 (0.67) KMT2AMEN1MAPTPOLBALDH1A1
SCHEMBL642700 0.82 KMT2A (0.81) KMT2AMEN1MAPTPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0610653-B1 Thermosensitive recording material NEW OJI PAPER CO LTD (JP) 1997-04-16 EP claimed
US-5444036-A Arylsulfonylureido compound, acetoacetanilide compound, sulfonamide derivative; storage stability NEW OIL PAPER CO., LTD. (JP) 1995-08-22 US claimed
EP-0610653-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1994-08-17 EP claimed
WO-2025100475-A1 COMPOSITION FOR IMAGE RECORDING AND METHOD FOR PRODUCING SAME キヤノン株式会社 2025-05-15 WO disclosed
US-20230158025-A1 GALACTOKINASE INHIBITORS NATIONAL INSTITUTES OF HEALTH 2023-05-25 US disclosed
WO-2021216812-A1 GALACTOKINASE INHIBITORS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2021-10-28 WO disclosed
US-9618867-B2 Pigment dispersion and toner CANON KABUSHIKI KAISHA (JP) 2017-04-11 US disclosed
US-9618867-B2 Pigment dispersion and toner CANON KABUSHIKI KAISHA (JP) 2017-04-11 US disclosed
EP-2843473-B1 Toner CANON KK (JP) 2016-11-02 EP disclosed
US-20160246200-A1 PIGMENT DISPERSION AND TONER CANON KABUSHIKI KAISHA (JP) 2016-08-25 US disclosed
US-20160246200-A1 PIGMENT DISPERSION AND TONER CANON KABUSHIKI KAISHA (JP) 2016-08-25 US disclosed
US-5444036-A Arylsulfonylureido compound, acetoacetanilide compound, sulfonamide derivative; storage stability NEW OIL PAPER CO., LTD. (JP) 1995-08-22 US disclosed
US-5371099-A Antiinflammatory agents ROUSSEL-UCLAF (FR) 1994-12-06 US disclosed
EP-0610653-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1994-08-17 EP disclosed
EP-0573318-A1 Phenyl carboxamide isoxazole derivatives and salts, process for their preparation and the new intermediates thereof. Their use as pharmaceuticals and pharmaceutical compositions containing them ROUSSEL UCLAF (FR) 1993-12-08 EP disclosed
US-4739083-A REACTING 1,3-DIOXAN-4-ONE WITH (AMINE OR IMINE) SUBSTITUTED AMIDE DAICEL CHEMICAL INDUSTRIES LTD. (JP) 1988-04-19 US disclosed
US-4366098-A FROM 6-AMINOPENICILIANIC ACID AND ANHYDRIDE OF AMIDE-TYPE DANE SALT WITH ALKYL OR ARALKYL CHLOROCARBONATE AMERICAN HOME PRODUCTS CORPORATION (US) 1982-12-28 US disclosed
US-4342684-A USED FOR DYEING LEATHER, WOOL, SILK AND POLYAMIDES P C U K PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1982-08-03 US disclosed
US-4301072-A Process for preparing aminopenicillins AMERICAN HOME PRODUCTS CORPORATION (US) 1981-11-17 US disclosed
US-4231954-A Dane salt and process for preparing aminopenicillins therefrom AMERICAN HOME PRODUCTS CORPORATION (US) 1980-11-04 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 (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-20230158025-A1 GALACTOKINASE INHIBITORS GALK1, GCK, GCKR KMT2A 2760/4885MEN1 3309/4885MAPT 2129/4885

“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.