SCHEMBL4989506

SCHEMBL4989506

CCNC(=O)C(CS)NC(=O)C(=O)NC(CS)C(=O)NCC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
ALOX15 P16050 1/20 0.45
NFKB1 P19838 1/20 0.45
PTGS2 P35354 1/20 0.45
THPO P40225 1/20 0.45
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PTGS1 P23219 1/20 0.37
GSTK1 Q9Y2Q3 1/20 0.37
FOLH1 Q04609 1/20 0.35
TGFBR1 P36897 2/20 0.33
MME P08473 1/20 0.33

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
SCHEMBL4986815 0.86 ACE (0.44) ACEKDM4EMAPTTHRBALOX15
SCHEMBL21153020 0.86 KDM4E (0.64) ACEKDM4EMAPTTHRBALOX15
SCHEMBL14099595 0.86 KDM4E (0.64) ACEKDM4EMAPTTHRBALOX15
SCHEMBL14611666 0.86 KDM4E (0.64) ACEKDM4EMAPTTHRBALOX15
SCHEMBL27447130 0.84 ACE (0.52) ACEKDM4EMAPTTHRBALOX15
SCHEMBL12157386 0.84 ACE (0.43) ACEKDM4EMAPTTHRBALOX15
SCHEMBL21134859 0.82 ACE (0.46) ACEKDM4EMAPTTHRBALOX15
SCHEMBL21153021 0.82 ACE (0.46) ACEKDM4EMAPTTHRBALOX15
SCHEMBL21135091 0.82 ACE (0.46) ACEKDM4EMAPTTHRBALOX15
SCHEMBL21134801 0.82 ACE (0.46) ACEKDM4EMAPTTHRBALOX15

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 ACE 3276/4885KDM4E 1902/4885MAPT 1421/4885

“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.