SCHEMBL4990753

SCHEMBL4990753

CNC(=O)C(CS)C(=O)NCCNC(=O)C(CS)C(=O)NC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.41
TSHR P16473 1/20 0.41
MMP8 P22894 2/20 0.35
BMP1 P13497 1/20 0.33
MMP1 P03956 4/20 0.33
MMP3 P08254 3/20 0.33
MMP9 P14780 3/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
ANPEP P15144 1/20 0.31
ENPEP Q07075 1/20 0.31
ALDH1A2 O94788 1/20 0.31
ALDH2 P05091 1/20 0.31
ALDH1A3 P47895 1/20 0.31
ACE P12821 1/20 0.31

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
SCHEMBL4995068 0.92 ALDH1A2 (0.38) USP2TSHRMMP8BMP1MMP1
SCHEMBL4983581 0.83 USP2 (0.46) USP2TSHRMMP8MMP1MMP3
SCHEMBL4991495 0.82 MMP1 (0.35) BMP1MMP1MMP3MMP9
SCHEMBL4986150 0.79 USP2 (0.41) USP2TSHRMMP8MEN1KMT2A
SCHEMBL4987650 0.77 TSHR (0.40) USP2TSHRMMP8MEN1KMT2A
SCHEMBL4989146 0.76 USP2 (0.38) USP2TSHRMMP8MEN1KMT2A
SCHEMBL4984807 0.75 USP2 (0.43) USP2TSHRMMP8MEN1KMT2A
SCHEMBL4990061 0.75 FNTA (0.40) USP2TSHRMMP8MEN1KMT2A
SCHEMBL4990338 0.74 TSHR (0.42) USP2TSHRMMP8MEN1KMT2A
SCHEMBL4988065 0.71 FNTA (0.43) MMP8KMT2AALDH1A1MAPTFNTA

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 USP2 2774/4885TSHR 3476/4885MMP8 2675/4885

“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.