SCHEMBL232779

SCHEMBL232779

O=C(O)c1cc(C(=O)O)cc([N+](=O)[O-])c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.64
TDP1 Q9NUW8 1/20 0.61
CYP3A4 P08684 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
SRD5A2 P31213 1/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ATM Q13315 1/20 0.51
ALOX5 P09917 2/20 0.50
LMNA P02545 1/20 0.50
CASP6 P55212 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
CYP19A1 P11511 1/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPT P10636 2/20 0.48
CASR P41180 1/20 0.48
KDM4E B2RXH2 1/20 0.48

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
Methane SCHEMBL7896214 0.98 TP53 (0.62) TP53TDP1CYP3A4SMN1; SMN2SRD5A2
SCHEMBL8060267 0.98 TP53 (0.62) TP53TDP1CYP3A4SMN1; SMN2SRD5A2
SCHEMBL28138389 0.98 TP53 (0.62) TP53TDP1CYP3A4SMN1; SMN2SRD5A2
SCHEMBL9133420 0.98 TP53 (0.62) TP53TDP1CYP3A4SMN1; SMN2SRD5A2
Hydrochloric Acid SCHEMBL2299193 0.98 TP53 (0.62) TP53TDP1CYP3A4SMN1; SMN2SRD5A2
SCHEMBL28117879 0.98 TP53 (0.62) TP53TDP1CYP3A4SMN1; SMN2SRD5A2
SCHEMBL28172063 0.98 TP53 (0.62) TP53TDP1CYP3A4SMN1; SMN2SRD5A2
Hydrochloric Acid SCHEMBL3088495 0.98 TP53 (0.62) TP53TDP1CYP3A4SMN1; SMN2SRD5A2
SCHEMBL28559760 0.96 TP53 (0.60) TP53TDP1CYP3A4SMN1; SMN2SRD5A2
SCHEMBL11650511 0.96 TP53 (0.60) TP53TDP1CYP3A4SMN1; SMN2SRD5A2

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

Appears in 2089 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121609930-B Copper-based coordination polymer, preparation method and application thereof in nitrogen fertilizer synergism 中国科学院沈阳应用生态研究所 2026-05-12 CN claimed
EP-4234642-B1 AQUEOUS TEXTURED PAINT COATING COMPOSITION, PAINT COATING FROM THE AQUEOUS TEXTURED PAINT COATING COMPOSITION, METAL SUBSTRATE COMPRISING THE PAINT COATING, USE OF THE AQUEOUS TEXTURED PAINT COATING COMPOSITION AND METHOD FOR COATING A METAL SUBSTRATE WITH THE AQUEOUS TEXTURED PAINT COATING COMPOSITION DAW SE (DE) 2026-04-15 EP claimed
US-12576386-B2 Aluminum-based metal-organic framework having three dimensional porous structure and comprising at least two types of ligands, preparation method therefor, and use thereof KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2026-03-17 US claimed
US-12559696-B2 Amine containing aqueous fluids and method of producing same ILLINOIS TOOL WORKS INC. (US) 2026-02-24 US claimed
US-20260034095-A1 GLYCOPYRROLATE SALTS JOURNEY MEDICAL CORP (US) 2026-02-05 US claimed
US-12480033-B2 Water soluble anionic metal-organic cages as cation capture species for scale reduction HALLIBURTON ENERGY SERVICES, INC. (US) 2025-11-25 US claimed
US-20250186395-A1 GLYCOPYRROLATE SALTS JOURNEY MEDICAL CORP (US) 2025-06-12 US claimed
CN-120113681-A Composite disinfectant containing chlorine dioxide and preparation process thereof 山东兆冠药业有限公司 2025-06-10 CN claimed
CN-119407166-B Silver-plated copper powder with small particle size and preparation method and application thereof 安徽壹石通材料科技股份有限公司 2025-04-29 CN claimed
CN-119607909-A Asymmetric two-dimensional metal organic framework film and preparation and separation application thereof 中国科学院大连化学物理研究所 2025-03-14 CN claimed
EP-0218677-B1 CORROSION INHIBITING QUENCHANT COMPOSITIONS UNION CARBIDE CORPORATION (US) 1990-07-25 EP claimed
EP-0218677-A1 CORROSION INHIBITING QUENCHANT COMPOSITIONS. UNION CARBIDE CORP (US) 1987-04-22 EP claimed
WO-1986005823-A1 CORROSION INHIBITING QUENCHANT COMPOSITIONS UNION CARBIDE CORPORATION (US) 1986-10-09 WO claimed
US-4595425-A Water soluble aromatic carboxylic acid containing nitro substituent, hydroxy substituted aromatic acid or salt UNION CARBIDE CORPORATION (US) 1986-06-17 US claimed
EP-0026709-B1 POLY(ALKYLENE OXIDE)COMPOSITION CONTAINING A NITRO-SUBSTITUTED AROMATIC COMPOUND UNION CARBIDE CORPORATION (US) 1984-06-13 EP claimed
US-4277366-A CONTAINING AN AROMATIC NITRO COMPOUND; INHIBITS CORROSION OF STEELS UNION CARBIDE CORPORATION (US) 1981-07-07 US claimed
EP-0026709-A2 Poly(alkylene oxide)composition containing a nitro-substituted aromatic compound UNION CARBIDE CORPORATION (US) 1981-04-08 EP claimed
US-4244989-A USING AN ABRASIVE COATED WITH A BINDER AND A CORROSION-RESISTANT SALT AKZO N.V. (NL) 1981-01-13 US claimed
US-4089690-A ZINC SALT OF 5-NITROISOPHTHALIC ACID OR MONONITRO TEREPHTHALIC ACID BASF FARBEN & FASERN AG (DT) 1978-05-16 US claimed
US-4005145-A ISOMERIZATION OF A,B-UNSATURATED OXO COMPOUNDS TO B,G-ISOMER HOFFMANN-LA ROCHE INC. (US) 1977-01-25 US claimed