SCHEMBL376278

SCHEMBL376278

O=[N+]([O-])c1cccc2c1NCC2

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.47
ALDH1A1 P00352 4/20 0.45
MAPT P10636 2/20 0.45
CYP3A4 P08684 1/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
ACHE P22303 1/20 0.42
GPR35 Q9HC97 2/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 1/20 0.39
TSHR P16473 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PDE10A Q9Y233 1/20 0.39
S100A4 P26447 1/20 0.38

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
SCHEMBL10400093 0.90 SRC (0.47) PNMTALDH1A1MAPTCYP3A4ALOX15
2-Chloropyridine SCHEMBL9390160 0.85 TDP1 (0.41) PNMTALDH1A1MAPTTDP1HTR2A
Quinoline SCHEMBL27724871 0.84 POLB (0.49) ALDH1A1MAPTTDP1TSHRPDE10A
Ethoxycarbonyl Group SCHEMBL27597891 0.84 PNMT (0.36) PNMTALDH1A1MAPTCYP3A4ALOX15
SCHEMBL28083310 0.83 PNMT (0.36) PNMTALDH1A1MAPTCYP3A4ALOX15
SCHEMBL4718488 0.78 ACHE (0.50) PNMTALDH1A1MAPTCYP3A4ALOX15
SCHEMBL6200472 0.78 MAPT (0.57) PNMTALDH1A1MAPTALOX15HSD17B10
Indoline SCHEMBL27976781 0.77 ALDH1A1 (0.51) PNMTALDH1A1MAPTCYP3A4ALOX15
SCHEMBL9501421 0.76 TDP1 (0.45) PNMTALDH1A1MAPTHSD17B10TDP1
SCHEMBL31357065 0.76 TDP1 (0.45) PNMTALDH1A1MAPTHSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12427196-B2 Macromolecular prodrugs for light-emitting diodes and uses thereof CHILDREN'S MEDICAL CENTER CORPORATION (US) 2025-09-30 US claimed
US-12227613-B2 Photo-patternable organic semiconductor (OSC) polymers and methods of formation and applications thereof CORNING INCORPORATED (US) 2025-02-18 US claimed
WO-2025029623-A2 LIGHT-TRIGGERED POLYMER-NALOXONE CONJUGATE FOR OPIOID REVERSAL THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2025-02-06 WO claimed
US-20230346942-A1 MACROMOLECULAR PRODRUGS FOR LIGHT-EMITTING DIODES AND USES THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-11-02 US claimed
US-20220411790-A1 A CRISPR-CAS9 PLATFORM WITH AN INTRINSIC OFF-SWITCH AND ENHANCED SPECIFICITY THE JOHNS HOPKINS UNIVERSITY 2022-12-29 US claimed
EP-4090374-A1 MACROMOLECULAR PRODRUGS FOR LIGHT-EMITTING DIODES AND USES THEREOF Children's Medical Center Corporation (US) 2022-11-23 EP claimed
CN-114380982-A Photopatternable Organic Semiconductor (OSC) polymers, methods of forming the same, and uses thereof 康宁股份有限公司 2022-04-22 CN claimed
US-20220119591-A1 PHOTO-PATTERNABLE ORGANIC SEMICONDUCTOR (OSC) POLYMERS AND METHODS OF FORMATION AND APPLICATIONS THEREOF CORNING INCORPORATED 2022-04-21 US claimed
WO-2021146553-A1 MACROMOLECULAR PRODRUGS FOR LIGHT-EMITTING DIODES AND USES THEREOF CHILDREN'S MEDICAL CENTER CORPORATION (US) 2021-07-22 WO claimed
WO-2021081468-A1 A CRISPR-CAS9 PLATFORM WITH AN INTRINSIC OFF-SWITCH AND ENHANCED SPECIFICITY THE JOHNS HOKINS UNIVERSITY (US) 2021-04-29 WO claimed
CN-104399364-A Method of utilizing nitryl-containing ionic liquid to absorb sulfur dioxide gas UNIV HENAN NORMAL 2015-03-11 CN claimed
WO-2014150851-A1 NUCLEOTIDE ANALOGS FOR SEQUENCING IBIS BIOSCIENCES, INC. (US) 2014-09-25 WO claimed
CN-103880730-A Chemical synthesis method of 7-nitroindole-3-tert butyl formate UNIV NANTONG 2014-06-25 CN claimed
EP-1757585-B1 Anionically substituted 7-Nitroindoline derivatives and their uses MEDICAL RES COUNCIL (GB) 2010-12-01 EP claimed
EP-1377548-B1 PROCESS FOR NITRATING PHOTOCLEAVABLE COMPOUNDS MEDICAL RES COUNCIL (GB) 2009-02-18 EP claimed
US-20070203099-A1 Anionically substituted 7-nitroindoline derivatives and their uses UNITED KINGDOM RESEARCH AND INNOVATION (GB) 2007-08-30 US claimed
EP-1757585-A1 Anionically substituted 7-Nitroindoline derivatives and their uses Medical Research Council (GB) 2007-02-28 EP claimed
US-20040171846-A1 Process for nitrating photocleavable compounds MEDICAL RESEARCH COUNCIL (GB) 2004-09-02 US claimed
EP-1377548-A1 PROCESS FOR NITRATING PHOTOCLEAVABLE COMPOUNDS MEDICAL RESEARCH COUNCIL (GB) 2004-01-07 EP claimed
WO-2002083639-A1 PROCESS FOR NITRATING PHOTOCLEAVABLE COMPOUNDS MEDICAL RESEARCH COUNCIL (GB) 2002-10-24 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20040171846-A1 Process for nitrating photocleavable compounds NOS2, SOD1, NIT2 PNMT 1184/4885ALDH1A1 175/4885MAPT 3106/4885
US-20070203099-A1 Anionically substituted 7-nitroindoline derivatives and their uses SLC18A3, SLC18A1, SLC18A2 PNMT 34/4885ALDH1A1 2026/4885MAPT 2542/4885
US-12427196-B2 Macromolecular prodrugs for light-emitting diodes and uses thereof CRY1, MAPT, PYGL PNMT 4558/4885ALDH1A1 650/4885MAPT 2/4885
US-20230346942-A1 MACROMOLECULAR PRODRUGS FOR LIGHT-EMITTING DIODES AND USES THEREOF CRY1, MAPT, PYGL PNMT 4558/4885ALDH1A1 650/4885MAPT 2/4885

“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.