SCHEMBL2433562

SCHEMBL2433562

NC(=O)c1ccc(C(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.66
LMNA P02545 1/20 0.65
TSHR P16473 2/20 0.60
HCAR3 P49019 12/20 0.55
PARP1 P09874 1/20 0.54
APEX1 P27695 1/20 0.51
POLB P06746 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
SCHEMBL8349696 0.89 PARP1 (0.67) CASP6LMNATSHRPARP1POLB
SCHEMBL842661 0.87 CASP6 (0.72) CASP6LMNATSHRHCAR3APEX1
SCHEMBL30810715 0.87 CASP6 (0.72) CASP6LMNATSHRHCAR3APEX1
SCHEMBL145092 0.87 CASP6 (0.72) CASP6LMNATSHRHCAR3APEX1
SCHEMBL8787371 0.86 PARP1 (0.63) CASP6LMNATSHRHCAR3PARP1
Ammonia Solution, Strong SCHEMBL32680170 0.86 CASP6 (0.70) CASP6LMNATSHRHCAR3APEX1
Terephthalic Acid SCHEMBL15808957 0.86 CASP6 (0.70) CASP6LMNATSHRHCAR3APEX1
SCHEMBL11649278 0.86 CASP6 (0.70) CASP6LMNATSHRHCAR3APEX1
SCHEMBL2910300 0.85 PARP1 (0.53) CASP6LMNATSHRPARP1POLB
Hydrochloric Acid SCHEMBL11776647 0.85 PARP1 (0.61) CASP6LMNATSHRHCAR3PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112795993-B Antibacterial and anti-mildew fiber pen point and preparation method thereof 温州市四通制笔零件有限公司 2022-05-10 CN claimed
CN-112795993-A Antibacterial and anti-mildew fiber pen point and preparation method thereof 温州市四通制笔零件有限公司 2021-05-14 CN claimed
US-4551549-A AMMONOLYSIS OF DIALKYL NITROTEREPHTHALATES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-11-05 US claimed
US-4399303-A Preparation and use of nitroterephthalamic acids E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-08-16 US claimed
CN-112028793-B Method for preparing nitrile by bismuth complex catalytic amide dehydration 浙江大学衢州研究院 2023-03-10 CN disclosed
CN-112010777-B Method for continuously preparing nitrile from amide in pipeline reactor 浙江大学衢州研究院 2022-10-11 CN disclosed
CN-112028726-B Method for continuously preparing nitrile from amide 浙江大学衢州研究院 2022-08-12 CN disclosed
CN-112795993-B Antibacterial and anti-mildew fiber pen point and preparation method thereof 温州市四通制笔零件有限公司 2022-05-10 CN disclosed
CN-112795993-A Antibacterial and anti-mildew fiber pen point and preparation method thereof 温州市四通制笔零件有限公司 2021-05-14 CN disclosed
CN-112028793-A Method for preparing nitrile by bismuth complex catalytic amide dehydration 浙江大学衢州研究院 2020-12-04 CN disclosed
CN-112028726-A Method for continuously preparing nitrile from amide 浙江大学衢州研究院 2020-12-04 CN disclosed
CN-112010777-A Method for continuously preparing nitrile from amide in pipeline reactor 浙江大学衢州研究院 2020-12-01 CN disclosed
US-20090163471-A1 Tropane compounds EXELIXIS, INC. 2009-06-25 US disclosed
WO-2009055077-A1 TROPANE COMPOUNDS EXELIXIS, INC. (US) 2009-04-30 WO disclosed
EP-0670855-A1 NITRO OR NITROSO GROUP TERMINATED MESOGENIC EPOXY RESIN ADDUCTS THE DOW CHEMICAL COMPANY (US) 1995-09-13 EP disclosed
WO-1994012555-A1 NITRO OR NITROSO GROUP TERMINATED MESOGENIC EPOXY RESIN ADDUCTS THE DOW CHEMICAL COMPANY (US) 1994-06-09 WO disclosed
US-4551549-A AMMONOLYSIS OF DIALKYL NITROTEREPHTHALATES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-11-05 US disclosed
US-4551549-A AMMONOLYSIS OF DIALKYL NITROTEREPHTHALATES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-11-05 US disclosed
US-4399303-A Preparation and use of nitroterephthalamic acids E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-08-16 US disclosed
US-4399303-A Preparation and use of nitroterephthalamic acids E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-08-16 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-20090163471-A1 Tropane compounds ADRA1B, ADRA2B, ADRB2 CASP6 3998/4885LMNA 486/4885TSHR 172/4885

“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.