SCHEMBL308403

SCHEMBL308403

O=c1ccc([N+](=O)[O-])c[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
GLA P06280 1/20 0.47
MAPT P10636 2/20 0.46
POLB P06746 1/20 0.46
GFER P55789 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
MCL1 Q07820 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ACHE P22303 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP3A4 P08684 2/20 0.42
GRIA1 P42261 1/20 0.42
GRIA2 P42262 1/20 0.42
GRIA3 P42263 1/20 0.42
GRIA4 P48058 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
APP P05067 1/20 0.42
PTPRC P08575 1/20 0.42
S100A4 P26447 1/20 0.42

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
Fluoromethane SCHEMBL28051653 0.94 HSD17B10 (0.43) ALDH1A1GLAMAPTPOLBGFER
Chloromethane SCHEMBL28051667 0.94 HSD17B10 (0.43) ALDH1A1GLAMAPTPOLBGFER
SCHEMBL11163286 0.88 MAPT (0.49) ALDH1A1MAPTPOLBGFERCACNA1B
SCHEMBL3179819 0.79 HSPB1 (0.56) ALDH1A1MAPTPOLBL3MBTL1LMNA
SCHEMBL11153190 0.77 MAPT (0.56) MAPTPOLBTDP1LMNA
SCHEMBL925941 0.76 ALDH1A1 (0.53) ALDH1A1GLAMAPTPOLBGFER
SCHEMBL7364055 0.73 RAB9A (0.48) ALDH1A1MAPTPOLBGFERCACNA1B
SCHEMBL27909482 0.71 ALDH1A1 (0.72) ALDH1A1ACHEHSD17B10TDP1APP
SCHEMBL22567 0.71 ALDH1A1 (0.72) ALDH1A1ACHEHSD17B10TDP1APP
SCHEMBL28198 0.69 CA1 (0.67) ALDH1A1MAPTPOLBACHEHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117776830-A Full deuteration preparation method of polycyclic aromatic hydrocarbon 宁波萃英化学技术有限公司 2024-03-29 CN claimed
CN-106632004-A Pyridone derivative, and preparation method and application thereof 山东大学 2017-05-10 CN claimed
US-20260001830-A1 PROCESS FOR PD(II)-CATALYZED SITE-SELECTIVE BETA- AND GAMMA-C(SP3)-H ARYLATION OF PRIMARY ALDEHYDES CONTROLLED BY TRANSIENT DIRECTING GROUPS SCRIPPS RESEARCH INST (US) 2026-01-01 US disclosed
EP-4642777-A1 INHIBITORS OF KIF18A AND USES THEREOF Insilico Medicine IP Limited (HK) 2025-11-05 EP disclosed
US-20250214969-A1 PROTEIN DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-07-03 US disclosed
EP-4499149-A1 PROTEIN DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2025-02-05 EP disclosed
EP-4499068-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2025-02-05 EP disclosed
US-12180221-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-12-31 US disclosed
EP-4472942-A2 PROCESS FOR PD(II)-CATALYZED SITE-SELECTIVE BETA- AND GAMMA-C(SP3)-H ARYLATION OF PRIMARY ALDEHYDES CONTROLLED BY TRANSIENT DIRECTING GROUPS The Scripps Research Institute (US) 2024-12-11 EP disclosed
WO-2023147545-A9 PROCESS FOR PD(II)-CATALYZED SITE-SELECTIVE BETA- AND GAMMA-C(SP3)-H ARYLATION OF PRIMARY ALDEHYDES CONTROLLED BY TRANSIENT DIRECTING GROUPS THE SCRIPPS RESEARCH INSTITUTE (US) 2024-08-29 WO disclosed
EP-4405359-A2 MDM2 DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2024-07-31 EP disclosed
WO-2004060890-A1 2-OXOPYRIDIN-3-YL THIA (DI) AZOLE DERIVATES FOR USE IN THE TREATMENT OF CELL PROLIFERATION AND APOPTOSIS RELATED DISEASES AMGEN INC. (US) 2004-07-22 WO disclosed
US-20040082574-A1 Compounds with the bicyclo[4.2.1]nonane system for the treatment of flavivridae infections PHARMASSET, INC. 2004-04-29 US disclosed
WO-2004013300-A2 COMPOUNDS WITH THE BICYCLO[4.2.1]NONANE SYSTEM FOR THE TREATMENT OF FLAVIVIRIDAE INFECTIONS PHARMASSET INC. (US) 2004-02-12 WO disclosed
US-5272170-A Tetralones with pharmacological activity J. URIACH & CIA., S.A. (ES) 1993-12-21 US disclosed
US-5208246-A Hypotensive, bronchodilator J. URIACH & CIA. (ES) 1993-05-04 US disclosed
EP-0489300-A2 Tetralones with pharmacological activity J. URIACH & CIA. S.A. (ES) 1992-06-10 EP disclosed
EP-0147105-B1 PHOTOGRAPHIC PRODUCTS EMPLOYING NOVEL NONDIFFUSIBLE HYDRAZONE DYE-RELEASING COMPOUNDS EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1988-05-11 EP disclosed
US-4548888-A DIFFUSION TRANSFER EASTMAN KODAK COMPANY (US) 1985-10-22 US disclosed
EP-0147105-A2 Photographic products employing novel nondiffusible hydrazone dye-releasing compounds EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1985-07-03 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 (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-20040082574-A1 Compounds with the bicyclo[4.2.1]nonane system for the treatment of flavivridae infections CYP4B1, HAVCR2, CYP2S1 ALDH1A1 1212/4885GLA 4126/4885MAPT 3805/4885
US-20250214969-A1 PROTEIN DEGRADERS AND USES THEREOF MDM2, CUL1, PSMG3 ALDH1A1 3843/4885GLA 1859/4885MAPT 489/4885
US-12180221-B2 Compounds and uses thereof NLN, ACHE, CLN6 ALDH1A1 656/4885GLA 1436/4885MAPT 22/4885
US-20260001830-A1 PROCESS FOR PD(II)-CATALYZED SITE-SELECTIVE BETA- AND GAMMA-C(SP3)-H ARYLATION OF PRIMARY ALDEHYDES CONTROLLED BY TRANSIENT DIRECTING GROUPS PDCD1LG2, PDCD1, CD274 ALDH1A1 177/4885GLA 1569/4885MAPT 2902/4885

“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.