SCHEMBL559830

SCHEMBL559830

COC(=O)c1ccc(C(=O)OC)c([N+](=O)[O-])c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 1/20 0.64
HPGD P15428 4/20 0.56
ALDH1A1 P00352 3/20 0.56
KDM4E B2RXH2 2/20 0.56
HSD17B10 Q99714 2/20 0.56
GLA P06280 1/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.56
CASP1 P29466 1/20 0.56
CASP7 P55210 1/20 0.56
ATM Q13315 1/20 0.56
NPSR1 Q6W5P4 1/20 0.54
LMNA P02545 2/20 0.52
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
PKM P14618 1/20 0.50
PDGFRB P09619 1/20 0.50
FGFR1 P11362 1/20 0.50
PDGFRA P16234 1/20 0.50
FLT1 P17948 1/20 0.50

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
SCHEMBL30525281 1.00 VCAM1 (0.64) VCAM1HPGDALDH1A1KDM4EHSD17B10
Methane SCHEMBL27578247 0.98 VCAM1 (0.62) VCAM1HPGDALDH1A1KDM4EHSD17B10
SCHEMBL161836 0.90 CASP6 (0.60) VCAM1HPGDALDH1A1GAAMAPT
SCHEMBL2388784 0.90 VCAM1 (0.54) VCAM1HPGDALDH1A1KDM4EHSD17B10
SCHEMBL16960905 0.90 VCAM1 (0.54) VCAM1HPGDALDH1A1KDM4EHSD17B10
SCHEMBL2116235 0.90 VCAM1 (0.61) VCAM1HPGDALDH1A1KDM4EHSD17B10
SCHEMBL8000314 0.90 VCAM1 (0.61) VCAM1HPGDALDH1A1KDM4EHSD17B10
SCHEMBL6072302 0.89 PARP1 (0.56) VCAM1HPGDALDH1A1KDM4EHSD17B10
SCHEMBL11685716 0.89 VCAM1 (0.52) VCAM1HPGDALDH1A1KDM4EHSD17B10
SCHEMBL1661691 0.89 VCAM1 (0.59) VCAM1HPGDALDH1A1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4651988-A1 METHODS OF MAKING METAL-ORGANIC FRAMEWORKS WITH PRE-LIGANDS ExxonMobil Technology and Engineering Company (US) 2025-11-26 EP claimed
US-20240300983-A1 Method of Making Metal-Organic Frameworks With a Precursor and Crystallization Aid EXXONMOBIL TECHNOLOGY & ENGINEERING COMPANY (US) 2024-09-12 US claimed
US-20240254148-A1 METHODS OF MAKING METAL-ORGANIC FRAMEWORKS WITH PRE-LIGANDS EXXONMOBIL TECHNOLOGY & ENGINEERING COMPANY (US) 2024-08-01 US claimed
WO-2024155562-A1 METHODS OF MAKING METAL-ORGANIC FRAMEWORKS WITH PRE-LIGANDS ExxonMobil Technology and Engineering Company (US) 2024-07-25 WO claimed
EP-4363100-A1 METHOD OF MAKING METAL-ORGANIC FRAMEWORKS WITH A PRECURSOR AND CRYSTALLIZATION AID ExxonMobil Technology and Engineering Company (US) 2024-05-08 EP claimed
CN-117946436-A Ion exchange membrane and preparation method thereof 浙江聚合储能科技有限公司 2024-04-30 CN claimed
WO-2023278248-A1 METHOD OF MAKING METAL-ORGANIC FRAMEWORKS WITH A PRECURSOR AND CRYSTALLIZATION AID ExxonMobil Technology and Engineering Company (US) 2023-01-05 WO claimed
CN-114058001-A Flame-retardant anti-dripping copolyester and preparation method thereof 中国科学院成都有机化学有限公司 2022-02-18 CN claimed
CN-106045868-A Method for producing dimethyl aminoterephthalate through catalytic hydrogenation 济南和润化工科技有限公司 2016-10-26 CN claimed
CN-103524386-B The preparation method of 2-amino-4-Methanesulfomide methyl toluate JIANGSU DINGLONG TECHNOLOGY CO., LTD. (CN) 2016-05-18 CN claimed
CN-104072403-B A kind of method preparing compound UNC1215 CHENGDU UNIVERSITY (CN) 2016-04-13 CN claimed
CN-105063833-A Short fiber composite spinning device and spinning method thereof NINGXIA RONGCHANG CASHMERE GROUP CO LTD 2015-11-18 CN claimed
CN-104072403-A Method for preparing compound UNC1215 UNIV CHENGDU 2014-10-01 CN claimed
CN-103524386-A Method for preparing 2-amino-4-methanesulfonamide methylbenzoate BINHAI BAIYUN CHEMICAL CO LTD 2014-01-22 CN claimed
CN-102516814-B High-strength yellow azo mixed pigment ANSHAN HIFICHEM CO LTD 2013-12-11 CN claimed
CN-102558906-B Yellow disazo mixed pigment with high tinting strength ANSHAN COLORFUL CHEMICAL CO LTD 2013-10-09 CN claimed
CN-101921386-A High-molecular-weight polyethylene terephthalate-lactic acid copolymer TORAY FIBER RES INST CN CO LTD 2010-12-22 CN claimed
CN-121426705-A Method for preparing methyl 2-nitro-4-cyanobenzoate 山东滨农科技有限公司 2026-01-30 CN disclosed
US-4399303-A Preparation and use of nitroterephthalamic acids E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-08-16 US disclosed
EP-0033720-A1 Esters, thioesters and amides of thioxanthone carbonxylic acid, their use as sensitizers or photo initiators and polymers CIBA-GEIGY AG (CH) 1981-08-12 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 (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-20240254148-A1 METHODS OF MAKING METAL-ORGANIC FRAMEWORKS WITH PRE-LIGANDS HCAR3, POF1B, HCAR1 VCAM1 1080/4885HPGD 160/4885ALDH1A1 363/4885

“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.