SCHEMBL2987301

SCHEMBL2987301

OCC(O)N(CCc1ccc(O)cc1O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.46
TYR P14679 6/20 0.46
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL2988485 0.89 EGFR (0.38) ALOX5MEN1TP53CYP3A4MAPT
SCHEMBL4130227 0.85 HTR1A (0.45) TSHR
SCHEMBL2990071 0.82 TYR (0.45) ALOX5TYR
SCHEMBL2990073 0.82 TYR (0.45) ALOX5TYR
SCHEMBL2978643 0.77 KDM4E (0.33)
SCHEMBL27796477 0.73 KDM4E (0.46) MEN1CYP3A4MAPTTSHRKMT2A
SCHEMBL2978165 0.71 EGFR (0.42) MEN1TP53CYP3A4MAPTALOX15
SCHEMBL2978168 0.71 EGFR (0.42) MEN1TP53CYP3A4MAPTALOX15
SCHEMBL1397158 0.67 TYR (1.00) ALOX5TYRMEN1TP53CYP3A4
SCHEMBL2982521 0.67 HTR1A (0.44) TYRMEN1TP53MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090074691-A1 Topical Delivery System for Antiaging and Skin Whitening Agents BIODERM RESEARCH (US) 2009-03-19 US claimed
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 ALOX5 63/4885TYR 1/4885MEN1 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.