Benzene

Benzene

SCHEMBL1147581

CCOc1ccc(OCC(C)(NS(C)(=O)=O)C(=O)NCCc2ccc(OC)c(OC)c2)cc1.c1ccccc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.56
▸ LMNA P02545 3/20 0.56
▸ ALDH1A1 P00352 6/20 0.54
▸ HPGD P15428 1/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ HTT P42858 1/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ PKM P14618 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ MEN1 O00255 1/20 0.46

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
SCHEMBL1147577 0.90 MAPT (0.54) MAPTLMNAALDH1A1HPGDSMN1; SMN2
Benzene SCHEMBL1148271 0.81 MEN1 (0.47) LMNAALDH1A1HPGDSMN1; SMN2HTT
Benzene SCHEMBL1148212 0.77 PLK1 (0.46) MAPTLMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL1148289 0.76 SMN1; SMN2 (0.44) MAPTLMNAALDH1A1SMN1; SMN2HTT
Benzene SCHEMBL1148245 0.76 MMP1 (0.39) MAPTLMNAHPGDSMN1; SMN2KMT2A
Benzene SCHEMBL1148166 0.75 POLB (0.41) MAPTLMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL10223234 0.72 CA12 (0.68) MAPTALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL1148267 0.71 MMP1 (0.47) MAPTLMNAALDH1A1HTTKMT2A
SCHEMBL6987265 0.71 KMT2A (0.57) MAPTLMNAALDH1A1HPGDSMN1; SMN2
Benzene SCHEMBL1147638 0.71 POLB (0.42) MAPTLMNAALDH1A1HPGDSMN1; SMN2

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
US-7884103-B2 such as N-(4-Chloro-phenyl)-2-methyl-2-phenylmethanesulfonylamino-3-(4-[1,2,4]triazol-1-yl-phenoxy)-propionamide, used for controlling or preventing the infestation of plants by phytopathogenic microorganisms, especially fungi SYNGENTA CROP PROTECTION, INC. (US) 2011-02-08 — — US claimed
US-20070155748-A1 N-sulfonyl-alpha-amino-acid derivatives SYNGENTA CROP PROTECTION, INC. 2007-07-05 — — US claimed
JP-2007504108-A — — 2007-03-01 — — JP claimed
EP-1660441-A2 N-SULFONYL-ALPHA-AMINO-ACID DERIVATIVES Syngenta Participations AG (CH) 2006-05-31 — — EP claimed
WO-2005021490-A2 N-SULFONYL-α-AMINO-ACID DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2005-03-10 — — WO claimed
US-7884103-B2 such as N-(4-Chloro-phenyl)-2-methyl-2-phenylmethanesulfonylamino-3-(4-[1,2,4]triazol-1-yl-phenoxy)-propionamide, used for controlling or preventing the infestation of plants by phytopathogenic microorganisms, especially fungi SYNGENTA CROP PROTECTION, INC. (US) 2011-02-08 — — US disclosed
US-20070155748-A1 N-sulfonyl-alpha-amino-acid derivatives SYNGENTA CROP PROTECTION, INC. 2007-07-05 — — US disclosed
EP-1660441-A2 N-SULFONYL-ALPHA-AMINO-ACID DERIVATIVES Syngenta Participations AG (CH) 2006-05-31 — — EP disclosed
WO-2005021490-A2 N-SULFONYL-α-AMINO-ACID DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2005-03-10 — — 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-20070155748-A1 N-sulfonyl-alpha-amino-acid derivatives C3AR1, GLRA1, C5AR1 MAPT 4811/4885LMNA 3821/4885ALDH1A1 1621/4885

“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.

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