SCHEMBL4990551

SCHEMBL4990551

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 2/20 0.45
ACE P12821 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
ALOX15 P16050 1/20 0.43
NFKB1 P19838 1/20 0.43
PTGS2 P35354 1/20 0.43
THPO P40225 1/20 0.43
RECQL P46063 1/20 0.43
BLM P54132 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MMP1 P03956 7/20 0.36
MMP9 P14780 8/20 0.35
MMP8 P22894 3/20 0.35
MMP2 P08253 2/20 0.35
MMP3 P08254 6/20 0.35
FOLH1 Q04609 1/20 0.33
PTGS1 P23219 1/20 0.33
GSTK1 Q9Y2Q3 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
SCHEMBL12632549 0.84 KDM4E (0.63) BMP1ACEKDM4EMAPTTHRB
SCHEMBL13299209 0.84 KDM4E (0.63) BMP1ACEKDM4EMAPTTHRB
SCHEMBL4988312 0.84 BMP1 (0.44) BMP1ACEKDM4EMAPTTHRB
SCHEMBL10045860 0.84 KDM4E (0.63) BMP1ACEKDM4EMAPTTHRB
SCHEMBL4704123 0.84 BMP1 (0.47) BMP1ACEKDM4EMAPTTHRB
SCHEMBL21134807 0.83 BMP1 (0.38) BMP1ACEKDM4EMAPTTHRB
SCHEMBL21134710 0.83 BMP1 (0.46) BMP1ACEKDM4EMAPTTHRB
SCHEMBL21153275 0.83 BMP1 (0.46) BMP1ACEKDM4EMAPTTHRB
SCHEMBL21135087 0.83 BMP1 (0.46) BMP1ACEKDM4EMAPTTHRB
SCHEMBL19934743 0.83 BMP1 (0.46) BMP1ACEKDM4EMAPTTHRB

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 4 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

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 BMP1 2537/4885ACE 3276/4885KDM4E 1902/4885

“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.