SCHEMBL4989672

SCHEMBL4989672

CN(C)C(=O)C(CS)NC(=O)C(=O)NC(CS)C(=O)N(C)C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 6/20 0.46
MMP8 P22894 5/20 0.46
MMP14 P50281 2/20 0.46
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
ALOX15 P16050 1/20 0.42
NFKB1 P19838 1/20 0.42
PTGS2 P35354 1/20 0.42
THPO P40225 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ACE P12821 1/20 0.38
FOLH1 Q04609 1/20 0.32
TGFBR1 P36897 2/20 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
SCHEMBL4986101 0.85 KDM4E (0.41) MMP9MMP8MMP14KDM4EMAPT
SCHEMBL7263731 0.85 MAPT (0.61) MMP9MMP8MMP14KDM4EMAPT
SCHEMBL27696220 0.85 MAPT (0.61) MMP9MMP8MMP14KDM4EMAPT
SCHEMBL928853 0.83 KDM4E (0.39) MMP9MMP8MMP14KDM4EMAPT
SCHEMBL930299 0.80 ACE (0.65) MMP9MMP8MMP14KDM4EMAPT
SCHEMBL930376 0.80 KDM4E (0.37) MMP9MMP8MMP14KDM4EMAPT
SCHEMBL929318 0.80 ACE (0.46) ACE
SCHEMBL930674 0.79 ACE (0.40) MMP9MMP8MMP14KDM4EMAPT
SCHEMBL4987659 0.79 KDM4E (0.36) MMP9MMP8MMP14KDM4EMAPT
SCHEMBL928887 0.79 KDM4E (0.53) MMP9MMP8MMP14KDM4EMAPT

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 2 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
US-20080138309-A1 Use Of Aminodithiol As A Reducing Agent For Hair Perming L'OREAL S.A. (FR) 2008-06-12 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-20080138309-A1 Use Of Aminodithiol As A Reducing Agent For Hair Perming AASDHPPT, BHMT2, ALAD MMP9 2823/4885MMP8 2675/4885MMP14 3636/4885

“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.