Benzene

Benzene

SCHEMBL790091

NCCS.c1ccccc1

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.73
TSHR P16473 1/20 0.73
ALDH1A1 P00352 1/20 0.67
LMNA P02545 1/20 0.67
MAPT P10636 1/20 0.67
BLM P54132 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
LOXL2 Q9Y4K0 2/20 0.35
TAAR1 Q96RJ0 2/20 0.35
CYP2A6 P11509 1/20 0.35
HTR2A P28223 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ESR1 P03372 1/20 0.33
HRH1 P35367 1/20 0.32
IDO1 P14902 1/20 0.32
MAOA P21397 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
Cysteamine SCHEMBL1270405 0.85
Cysteamine SCHEMBL16369 0.85
Cysteamine SCHEMBL8340751 0.85 TSHR (1.00) CYP3A4TSHRALDH1A1LMNAMAPT
Cysteamine SCHEMBL2357943 0.80
Cysteamine SCHEMBL21826826 0.80
Cysteamine SCHEMBL25318894 0.80
Cysteamine SCHEMBL21826833 0.80
Cysteamine SCHEMBL21981247 0.80
Cysteamine SCHEMBL25327317 0.80
Cysteamine SCHEMBL7624444 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9249181-B2 C-terminal amidation of polypeptides AMYLIN PHARMACEUTICALS, LLC (US) 2016-02-02 US claimed
US-20140058070-A1 C-TERMINAL AMIDATION OF POLYPEPTIDES AstraZeneca Pharmaceuticala LP (US) 2014-02-27 US claimed
WO-2012036962-A2 C-TERMINAL AMIDATION OF POLYPEPTIDES AMYLIN PHARMACEUTICALS, INC. (US) 2012-03-22 WO claimed
US-9249181-B2 C-terminal amidation of polypeptides AMYLIN PHARMACEUTICALS, LLC (US) 2016-02-02 US disclosed
US-9249181-B2 C-terminal amidation of polypeptides AMYLIN PHARMACEUTICALS, LLC (US) 2016-02-02 US disclosed
US-20140058070-A1 C-TERMINAL AMIDATION OF POLYPEPTIDES AstraZeneca Pharmaceuticala LP (US) 2014-02-27 US disclosed
WO-2012036962-A2 C-TERMINAL AMIDATION OF POLYPEPTIDES AMYLIN PHARMACEUTICALS, INC. (US) 2012-03-22 WO disclosed
US-3972890-A ACID CATALYST BAYER AKTIENGESELLSCHAFT (DT) 1976-08-03 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-20140058070-A1 C-TERMINAL AMIDATION OF POLYPEPTIDES IAPP, SELENOI, SCLY CYP3A4 3951/4885TSHR 362/4885ALDH1A1 4215/4885

“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.