SCHEMBL4988065

SCHEMBL4988065

O=C(O)C(CS)C(=O)NCCCNC(=O)C(CS)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 3/20 0.43
FNTB P49356 3/20 0.43
ALDH1A2 O94788 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ALDH2 P05091 1/20 0.41
ALDH1A3 P47895 1/20 0.41
ENPEP Q07075 2/20 0.37
MMP8 P22894 3/20 0.37
PTGS1 P23219 1/20 0.36
SLC7A11 Q9UPY5 1/20 0.36
PGGT1B P53609 1/20 0.35
ACE P12821 2/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
ALOX15 P16050 1/20 0.34
NFKB1 P19838 1/20 0.34
PTGS2 P35354 1/20 0.34
THPO P40225 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL4986150 0.91 USP2 (0.41) FNTAFNTBALDH1A2ALDH1A1ALDH2
SCHEMBL4986427 0.83 ALDH1A1 (0.39) FNTAFNTBALDH1A2ALDH1A1ALDH2
SCHEMBL4990061 0.81 FNTA (0.40) FNTAFNTBALDH1A2ALDH1A1ALDH2
SCHEMBL4995068 0.81 ALDH1A2 (0.38) FNTAFNTBALDH1A2ALDH1A1ALDH2
SCHEMBL4983533 0.79 ALDH1A2 (0.36) FNTAFNTBALDH1A2ALDH1A1ALDH2
SCHEMBL4989991 0.78 USP2 (0.36) FNTAFNTBALDH1A2ALDH1A1ALDH2
SCHEMBL4989705 0.77 TSHR (0.41) FNTAFNTBALDH1A2ALDH1A1ALDH2
SCHEMBL4991344 0.76 ENPEP (0.35) ENPEPPTGS1SLC7A11ACEKDM4E
SCHEMBL4989146 0.73 USP2 (0.38) ALDH1A2ALDH1A1ALDH2ALDH1A3ENPEP
SCHEMBL4990753 0.71 USP2 (0.41) FNTAFNTBALDH1A2ALDH1A1ALDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080138309-A1 Use Of Aminodithiol As A Reducing Agent For Hair Perming L'OREAL S.A. (FR) 2008-06-12 US claimed
EP-1844007-A1 USE OF AMINODITHIOL AS A REDUCING AGENT FOR HAIR PERMING L'Oréal (FR) 2007-10-17 EP claimed
WO-2006077170-A1 USE OF AMINODITHIOL AS A REDUCING AGENT FOR HAIR PERMING L'OREAL (FR) 2006-07-27 WO claimed
US-20080138309-A1 Use Of Aminodithiol As A Reducing Agent For Hair Perming L'OREAL S.A. (FR) 2008-06-12 US disclosed
EP-1844007-A1 USE OF AMINODITHIOL AS A REDUCING AGENT FOR HAIR PERMING L'Oréal (FR) 2007-10-17 EP disclosed
WO-2006077170-A1 USE OF AMINODITHIOL AS A REDUCING AGENT FOR HAIR PERMING L'OREAL (FR) 2006-07-27 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-20080138309-A1 Use Of Aminodithiol As A Reducing Agent For Hair Perming AASDHPPT, BHMT2, ALAD FNTA 1739/4885FNTB 2680/4885ALDH1A2 795/4885

“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.