Benzene

Benzene

SCHEMBL5152353

CN(C)P(=O)(F)N(C)C.c1ccccc1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.30

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
SCHEMBL118899 0.89
SCHEMBL6739890 0.89
Water SCHEMBL29412656 0.86
Chlorobenzene SCHEMBL5527741 0.81 TSHR (0.48) HTTMEN1KMT2AMAPT
Methylene Chloride SCHEMBL1604482 0.78 HTT (0.30) HTT
Dimethylformamide SCHEMBL4046504 0.75 TSHR (0.53)
SCHEMBL908858 0.75 CTSA (0.33)
SCHEMBL8091799 0.73 CA2 (0.34)
Benzene SCHEMBL11503207 0.72 HTT (0.48) HTTMEN1KMT2AMAPT
Diethylamine SCHEMBL17396366 0.71 TP53 (0.42)

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118307461-A Preparation method of light-induced palladium-catalyzed difluoro methylene indole compound 大连理工大学 2024-07-09 CN claimed
CN-118307461-A Preparation method of light-induced palladium-catalyzed difluoro methylene indole compound 大连理工大学 2024-07-09 CN disclosed
US-7196210-B2 Isoreticular metal-organic frameworks, process for forming the same, and systematic design of pore size and functionality therein, with application for gas storage THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-03-27 US disclosed
EP-1383775-B1 ISORETICULAR METAL-ORGANIC FRAMEWORKS, PROCESS FOR FORMING THE SAME, AND SYSTEMATIC DESIGN OF PORE SIZE AND FUNCTIONALITY THEREIN,WITH APPLICATION FOR GAS STORAGE UNIV MICHIGAN (US) 2006-08-02 EP disclosed
US-20050192175-A1 Isoreticular metal-organic frameworks, process for forming the same, and systematic design of pore size and functionality therein, with application for gas storage NATIONAL SCIENCE FOUNDATION 2005-09-01 US disclosed
US-6930193-B2 Isoreticular metal-organic frameworks, process for forming the same, and systematic design of pore size and functionality therein, with application for gas storage THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2005-08-16 US disclosed
EP-1383775-A1 ISORETICULAR METAL-ORGANIC FRAMEWORKS, PROCESS FOR FORMING THE SAME, AND SYSTEMATIC DESIGN OF PORE SIZE AND FUNCTIONALITY THEREIN,WITH APPLICATION FOR GAS STORAGE The Regents of The University of Michigan (US) 2004-01-28 EP disclosed
US-20030004364-A1 Isoreticular metal-organic frameworks, process for forming the same, and systematic design of pore size and functionality therein, with application for gas storage NATIONAL SCIENCE FOUNDATION 2003-01-02 US disclosed
WO-2002088148-A1 ISORETICULAR METAL-ORGANIC FRAMEWORKS, PROCESS FOR FORMING THE SAME, AND SYSTEMATIC DESIGN OF PORE SIZE AND FUNCTIONALITY THEREIN,WITH APPLICATION FOR GAS STORAGE THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2002-11-07 WO 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-20030004364-A1 Isoreticular metal-organic frameworks, process for forming the same, and systematic design of pore size and functionality therein, with application for gas storage IPO4, TPR, SMC4 HTT 2913/4885MEN1 3472/4885KMT2A 3957/4885

“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.