4-Methoxycinnamic Acid

4-Methoxycinnamic Acid

SCHEMBL27427329

CCO.CCO.COc1ccc(C=CC(=O)O)cc1.N

nearest known ligand 0.83

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Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of 4-Methoxycinnamic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.83
ATM Q13315 1/20 0.83
GSK3B P49841 2/20 0.65
F3 P13726 2/20 0.64
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
BACE1 P56817 1/20 0.59
HDAC3 O15379 2/20 0.58
HDAC1 Q13547 2/20 0.58
HDAC2 Q92769 2/20 0.58
HDAC8 Q9BY41 2/20 0.58
HDAC6 Q9UBN7 2/20 0.58
BCHE P06276 1/20 0.58
CYP3A4 P08684 1/20 0.58
NFKB1 P19838 1/20 0.58
NFKB2 Q00653 1/20 0.58
RELA Q04206 1/20 0.58
PTGER4 P35408 1/20 0.57
PTGER3 P43115 1/20 0.57
PTGER2 P43116 1/20 0.57

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
4-Methoxycinnamic Acid SCHEMBL28249256 0.98 THRB (0.86) THRBATMGSK3BF3NPC1
4-Methoxycinnamic Acid SCHEMBL2298853 0.93 THRB (0.96) THRBATMGSK3BF3NPC1
4-Methoxycinnamic Acid SCHEMBL2300953 0.93 THRB (0.96) THRBATMGSK3BF3NPC1
4-Methoxycinnamic Acid SCHEMBL12473722 0.91 THRB (1.00) THRBATMGSK3BF3NPC1
4-Methoxycinnamic Acid SCHEMBL58699 0.91 THRB (1.00) THRBATMGSK3BF3NPC1
4-Methoxycinnamic Acid SCHEMBL58700 0.91 THRB (1.00) THRBATMGSK3BF3NPC1
4-Methoxycinnamic Acid SCHEMBL10935651 0.90 THRB (0.96) THRBATMGSK3BF3NPC1
4-Methoxycinnamic Acid SCHEMBL4654596 0.90 THRB (0.96) THRBATMGSK3BF3NPC1
4-Methoxycinnamic Acid SCHEMBL5330596 0.90 THRB (0.96) THRBATMGSK3BF3NPC1
4-Methoxycinnamic Acid SCHEMBL711810 0.90 THRB (0.96) THRBATMGSK3BF3NPC1

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
CN-1111504-A Improved ultraviolet radiation absorbing composition and method ROHM & HAAS (US) 1995-11-15 CN claimed
CN-1111504-A Improved ultraviolet radiation absorbing composition and method ROHM & HAAS (US) 1995-11-15 CN disclosed