SCHEMBL3740070

SCHEMBL3740070

CC(=NC(Cc1ccccc1)C(=O)O)c1c(O)cccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.44
PKM P14618 1/20 0.44
PTGS1 P23219 1/20 0.44
XIAP P98170 1/20 0.44
SLC7A5 Q01650 1/20 0.44
CTRB1 P17538 4/20 0.42
CYP1A2 P05177 1/20 0.42
THRB P10828 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
PPARG P37231 2/20 0.39
PPARA Q07869 2/20 0.39
ACHE P22303 1/20 0.39
SGMS1 Q86VZ5 1/20 0.39
SGMS2 Q8NHU3 1/20 0.39
MIF P14174 1/20 0.39
BID P55957 1/20 0.38
BCL2L1 Q07817 1/20 0.38
MCL1 Q07820 1/20 0.38
BAK1 Q16611 1/20 0.38
PPIA P62937 1/20 0.38

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
SCHEMBL3740060 1.00 ALPI (0.44) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL3746912 0.92 SLC7A5 (0.46) SLC7A5THRBPPARGPPARAACHE
SCHEMBL3746895 0.92 SLC7A5 (0.46) SLC7A5THRBPPARGPPARAACHE
SCHEMBL3749764 0.83 THRB (0.44) THRBPPARGPPARASGMS1SGMS2
SCHEMBL3749774 0.83 THRB (0.44) THRBPPARGPPARASGMS1SGMS2
SCHEMBL3744431 0.82 THRB (0.43) THRBPPARGPPARASGMS1SGMS2
SCHEMBL3744442 0.82 THRB (0.43) THRBPPARGPPARASGMS1SGMS2
SCHEMBL3741886 0.81 THRB (0.37) THRBPPARGPPARABIDBCL2L1
SCHEMBL3741921 0.81 THRB (0.37) THRBPPARGPPARABIDBCL2L1
SCHEMBL23766637 0.79 ALPI (0.53) ALPIPKMPTGS1XIAPSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287536-A1 Skin and Hair Restoration by Natural Amino Acid and Peptide Crown Complexes BIODERM RESEARCH (US) 2008-11-20 US claimed
US-7834210-B2 Hair loss prevention by natural amino acid and peptide complexes BIODERM RESEARCH (US) 2010-11-16 US disclosed
US-20090253668-A1 Hair Loss Prevention by Natural Amino Acid and Peptide Complexes BIODERM RESEARCH (US) 2009-10-08 US disclosed
US-7572933-B2 Skin and hair restoration by natural amino acid peptide complexes BIODERM RESEARCH (US) 2009-08-11 US disclosed
US-20080287536-A1 Skin and Hair Restoration by Natural Amino Acid and Peptide Crown Complexes BIODERM RESEARCH (US) 2008-11-20 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 (2 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-20080287536-A1 Skin and Hair Restoration by Natural Amino Acid and Peptide Crown Complexes MMP17, MC1R, TYR ALPI 1146/4885PKM 2063/4885PTGS1 436/4885
US-20090253668-A1 Hair Loss Prevention by Natural Amino Acid and Peptide Complexes MMP1, MMP17, MMP13 ALPI 907/4885PKM 2607/4885PTGS1 1192/4885

“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.