SCHEMBL802998

SCHEMBL802998

COc1cc(CCNC(=O)/C=C/c2ccc(O)cc2)ccc1O

nearest known ligand 0.79

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.79
TYR P14679 2/20 0.79
BCHE P06276 1/20 0.74
MAPT P10636 4/20 0.70
HDAC1 Q13547 1/20 0.67
HDAC6 Q9UBN7 1/20 0.67
LMNA P02545 1/20 0.65
KDM4E B2RXH2 1/20 0.64
ALDH1A1 P00352 1/20 0.64
PKM P14618 1/20 0.64
APP P05067 1/20 0.62
ABCB1 P08183 1/20 0.62
AKR1B1 P15121 1/20 0.62
MAOA P21397 1/20 0.62
MAOB P27338 1/20 0.62

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
N-Trans-Feruloyl Tyramine SCHEMBL29477339 0.93 TYR (0.83) ACHETYRBCHEHDAC1HDAC6
N-Trans-Feruloyl Tyramine SCHEMBL17693085 0.93 TYR (0.83) ACHETYRBCHEHDAC1HDAC6
N-Trans-Feruloyl Tyramine SCHEMBL30069091 0.93 TYR (0.83) ACHETYRBCHEHDAC1HDAC6
N-Trans-Feruloyl Tyramine SCHEMBL2378679 0.93 TYR (0.83) ACHETYRBCHEHDAC1HDAC6
N-Trans-Feruloyl Tyramine SCHEMBL1675910 0.93 TYR (0.83) ACHETYRBCHEHDAC1HDAC6
SCHEMBL1917145 0.93 TYR (0.91) ACHETYRMAPTHDAC1HDAC6
SCHEMBL1842826 0.93 TYR (0.91) ACHETYRMAPTHDAC1HDAC6
SCHEMBL29363766 0.93 TYR (0.91) ACHETYRMAPTHDAC1HDAC6
SCHEMBL4812187 0.93 TYR (0.91) ACHETYRMAPTHDAC1HDAC6
SCHEMBL31252895 0.93 TYR (0.91) ACHETYRMAPTHDAC1HDAC6

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-9295624-B2 Amide derivative and whitening agent AJINOMOTO CO., INC. (JP) 2016-03-29 US disclosed
US-20140255327-A1 NOVEL AMIDE DERIVATIVE AND WHITENING AGENT AJINOMOTO CO. INC. (JP) 2014-09-11 US disclosed
US-20120070395-A1 NOVEL AMIDE DERIVATIVE AND WHITENING AGENT AJINOMOTO CO. INC (JP) 2012-03-22 US disclosed
EP-2412701-A1 NOVEL AMIDE DERIVATIVE AND SKIN WHITENING AGENT Ajinomoto Co., Inc. (JP) 2012-02-01 EP 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-20140255327-A1 NOVEL AMIDE DERIVATIVE AND WHITENING AGENT CUTA, NAT1, TYR ACHE 291/4885TYR 3/4885BCHE 965/4885
US-20120070395-A1 NOVEL AMIDE DERIVATIVE AND WHITENING AGENT CUTA, NAT1, TYR ACHE 291/4885TYR 3/4885BCHE 965/4885

“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.