N-Isoferuloyl Serotonin

N-Isoferuloyl Serotonin

SCHEMBL803830

COc1ccc(/C=C/C(=O)NCCc2c[nH]c3ccc(O)cc23)cc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.79
MAOB P27338 2/20 0.74
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
ACHE P22303 3/20 0.65
BCHE P06276 1/20 0.63
HDAC3 O15379 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
MAOA P21397 1/20 0.60
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
MAPT P10636 1/20 0.56
IDO1 P14902 1/20 0.56
HPGD P15428 1/20 0.56
SPR P35270 1/20 0.56
BLM P54132 1/20 0.56
NOTUM Q6P988 1/20 0.56

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-Feruloyl Serotonin SCHEMBL30037765 0.93 PTGS2 (0.79) PTGS2MAOBMEN1KMT2AACHE
N-Feruloyl Serotonin SCHEMBL1809357 0.93 PTGS2 (0.79) PTGS2MAOBMEN1KMT2AACHE
N-Feruloyl Serotonin SCHEMBL12063415 0.93 PTGS2 (0.79) PTGS2MAOBMEN1KMT2AACHE
SCHEMBL16414740 0.90 MEN1 (0.87) PTGS2MAOBMEN1KMT2AACHE
SCHEMBL16414743 0.90 MEN1 (0.87) PTGS2MAOBMEN1KMT2AACHE
N-Sinapoyl Serotonin SCHEMBL803240 0.89 MAOB (0.74) PTGS2MAOBMEN1KMT2AACHE
N-Caffeoylserotonin SCHEMBL803616 0.88 PTGS2 (1.00) PTGS2MAOBMEN1KMT2AACHE
N-Caffeoylserotonin SCHEMBL30039282 0.88 PTGS2 (1.00) PTGS2MAOBMEN1KMT2AACHE
N-Caffeoylserotonin SCHEMBL4294054 0.88 PTGS2 (1.00) PTGS2MAOBMEN1KMT2AACHE
N-P-Methoxy Cinnamoyl Serotonin SCHEMBL10071700 0.87 MAOB (0.82) PTGS2MAOBMEN1KMT2AACHE

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
EP-2412701-B1 NOVEL AMIDE DERIVATIVE AND SKIN WHITENING AGENT AJINOMOTO KK (JP) 2015-08-12 EP 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

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 PTGS2 2191/4885MAOB 416/4885MEN1 4229/4885
US-20120070395-A1 NOVEL AMIDE DERIVATIVE AND WHITENING AGENT CUTA, NAT1, TYR PTGS2 2191/4885MAOB 416/4885MEN1 4229/4885

“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.