SCHEMBL3336779

SCHEMBL3336779

O=[N+]([O-])C(CO)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.55
NPC1 O15118 1/20 0.40
ADAM17 P78536 1/20 0.40
TRPA1 O75762 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CPA1 P15085 3/20 0.37
CYP2D6 P10635 1/20 0.37
SRC P12931 1/20 0.37
ACP3 P15309 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CNR1 P21554 1/20 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
Fluoride SCHEMBL28046654 0.98 GSR (0.53) GSRNPC1ADAM17TRPA1ALDH1A1
SCHEMBL11043092 0.89 GSR (0.46) GSRTRPA1ALDH1A1LMNACYP2D6
SCHEMBL11130514 0.84 GSR (0.47) GSRNPC1ADAM17TRPA1ALDH1A1
SCHEMBL4851936 0.81 ALDH1A1 (0.47) GSRALDH1A1LMNAACP3MAPT
SCHEMBL6258107 0.80 ALDH1A1 (0.53) NPC1ALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL5164396 0.80 ACHE (0.42) GSRALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL2555564 0.80 GABBR2 (0.47) GSRCPA1CYP2D6SRCMAPT
SCHEMBL2461330 0.80 IGF1R (0.37) GSRALDH1A1LMNAKDM4EMAPT
SCHEMBL2461283 0.80 IGF1R (0.37) GSRALDH1A1LMNAKDM4EMAPT
SCHEMBL162874 0.79 TAAR1 (0.48) GSRNPC1ADAM17ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025007135-A9 CONTROLLED GLYCAN METABOLIC ENGINEERING SYSTEMS AND APPLICATIONS THEREOF WAYNE STATE UNIVERSITY (US) 2025-03-27 WO claimed
WO-2025007135-A2 CONTROLLED GLYCAN METABOLIC ENGINEERING SYSTEMS AND APPLICATIONS THEREOF WAYNE STATE UNIVERSITY (US) 2025-01-02 WO claimed
CN-105111086-A 1-phenyl-2-nitroethanol and preparation method of derivatives thereof UNIV NANJING INF SCI & TECH 2015-12-02 CN claimed
US-20100148632-A1 USE OF A PLASTICIZER IN AN ELECTROACTIVE POLYMER COMPOSITION NEDERLANDSE ORGANISATIE VOOR TOEGEPASTNATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2010-06-17 US claimed
EP-2052019-A1 USE OF A PLASTICIZER IN AN ELECTROACTIVE POLYMER COMPOSITION Nederlandse Centrale Organisatie Voor Toegepast Natuurwetenschappelijk Onderzoek TNO (NL) 2009-04-29 EP claimed
WO-2008010713-A1 USE OF A PLASTICIZER IN AN ELECTROACTIVE POLYMER COMPOSITION NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2008-01-24 WO claimed
EP-1881024-A1 Use of a plasticizer in an electroactive polymer composition Nederlandse Organisatie voor toegepast- natuurwetenschappelijk onderzoek TNO (NL) 2008-01-23 EP claimed
EP-3808786-B1 DEGRADABLE MICROSPHERE AND USE THEREOF UNIV TSINGHUA (CN) 2025-09-10 EP disclosed
US-12325767-B2 Degradable microsphere and use thereof TSINGHUA UNIVERSITY (CN) 2025-06-10 US disclosed
CN-120054619-A Catalyst for preparing chiral beta-amino alcohol and method for preparing chiral beta-amino alcohol using the same 北京旭阳科技有限公司 2025-05-30 CN disclosed
WO-2025007135-A9 CONTROLLED GLYCAN METABOLIC ENGINEERING SYSTEMS AND APPLICATIONS THEREOF WAYNE STATE UNIVERSITY (US) 2025-03-27 WO disclosed
WO-2025007135-A2 CONTROLLED GLYCAN METABOLIC ENGINEERING SYSTEMS AND APPLICATIONS THEREOF WAYNE STATE UNIVERSITY (US) 2025-01-02 WO disclosed
CN-112106158-B Electrolytic capacitor 松下知识产权经营株式会社 2022-08-12 CN disclosed
WO-1995031469-A1 PTERIDINE NUCLEOTIDE ANALOGS AS FLUORESCENT DNA PROBES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1995-11-23 WO disclosed
EP-0389521-A4 2',5'-PHOSPHOROTHIOATE OLIGOADENYLATES AND ANTIVIRAL USES THEREOF 1992-02-05 EP disclosed
EP-0389521-A1 2',5'-PHOSPHOROTHIOATE OLIGOADENYLATES AND ANTIVIRAL USES THEREOF Temple University of the Commonwealth System of Higher Education (US) 1990-10-03 EP disclosed
WO-1989003683-A1 2',5'-PHOSPHOROTHIOATE OLIGOADENYLATES AND ANTIVIRAL USES THEREOF TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HI (US) 1989-05-05 WO disclosed
US-4581178-A USING TRANSITION METAL COMPLEXES CONTAINING PHOSPHINE OR ARSINE LI E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-04-08 US disclosed
US-4374061-A ACTIVATION, AMINATION, AND DIAZOTIZATION OF A POLYSACCHARIDE FOLLOWED BY REACTION WITH A GLOBULIN; CHROMATOGRAPHY; SEPARATION OF GLYCOPROTEINS CENTER FOR BLOOD RESEARCH, INC. (US) 1983-02-15 US disclosed
US-4299992-A Process for the selective hydroxymethylation of nitrotoluenes REANAL FINOMVEGYSZERGYAR (HU) 1981-11-10 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-12325767-B2 Degradable microsphere and use thereof STUB1, PSMD14, ACP1 GSR 3812/4885NPC1 4754/4885ADAM17 241/4885

“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.