SCHEMBL2979330

SCHEMBL2979330

O=C(O)CNCCc1ccc(O)cc1O.[Mo]

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TYR P14679 4/20 0.53
POLB P06746 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX5 P09917 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL2987523 0.98 TYR (0.55) TYRPOLBMEN1KMT2ATP53
SCHEMBL2984775 0.97 TYR (0.53) TYRPOLBMEN1KMT2ATP53
SCHEMBL2986817 0.97 TYR (0.53) TYRPOLBMEN1KMT2ATP53
SCHEMBL3206953 0.87 TYR (0.53) TYRPOLB
SCHEMBL2985217 0.87 EGFR (0.50) TP53CYP3A4ALOX5MAPTALOX15
SCHEMBL2976423 0.83 TYR (0.52) TYRMEN1KMT2ATP53CYP3A4
Zinc Ion SCHEMBL2984772 0.83 TYR (0.52) TYRMEN1KMT2ATP53CYP3A4
SCHEMBL2979329 0.83 TYR (0.52) TYRMEN1KMT2ATP53CYP3A4
SCHEMBL2986815 0.83 TYR (0.52) TYRMEN1KMT2ATP53CYP3A4
SCHEMBL2978786 0.81 TYR (0.50) TYRMEN1KMT2ATP53CYP3A4

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-7777073-B2 Topical delivery system for antiaging and skin whitening agents BIODERM RESEARCH (US) 2010-08-17 US disclosed
US-20090074691-A1 Topical Delivery System for Antiaging and Skin Whitening Agents BIODERM RESEARCH (US) 2009-03-19 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-20090074691-A1 Topical Delivery System for Antiaging and Skin Whitening Agents TYR, MMP17, MMP1 TYR 1/4885POLB 247/4885MEN1 4836/4885

“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.