SCHEMBL2853922

SCHEMBL2853922

COc1cc(CNC(=O)C=Cc2ccc(C)cc2)ccc1O

nearest known ligand 0.81

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.65
TYR P14679 2/20 0.61
ACHE P22303 1/20 0.60
TRPV1 Q8NER1 1/20 0.59
HDAC3 O15379 1/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC2 Q92769 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
MMP9 P14780 1/20 0.58
KDM4E B2RXH2 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
SCHEMBL2853919 1.00 MAPT (0.65) MAPTTYRACHETRPV1HDAC3
SCHEMBL802713 0.92 ABCB1 (0.65) TYRACHETRPV1HDAC3HDAC1
SCHEMBL1916293 0.91 TYR (0.73) MAPTTYRACHETRPV1HDAC3
SCHEMBL12299018 0.91 TYR (0.73) MAPTTYRACHETRPV1HDAC3
SCHEMBL2847215 0.91 TYR (0.61) TYRACHETRPV1HDAC3HDAC1
SCHEMBL2847211 0.91 TYR (0.61) TYRACHETRPV1HDAC3HDAC1
SCHEMBL12246735 0.89 TYR (0.63) MAPTTYRACHETRPV1HDAC3
SCHEMBL7523933 0.89 TYR (0.71) MAPTTYRACHETRPV1HDAC3
SCHEMBL2875338 0.89 MAPT (0.64) MAPTTYRACHEMMP9
SCHEMBL2875339 0.89 MAPT (0.64) MAPTTYRACHEMMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778622-B1 PARA-ALKYL-SUBSTITUTED N-(4-HYDROXY-3-METHOXY-BENZYL) CINNAMAMIDES AND THE USE THEREOF FOR PRODUCING DRUGS GRUENENTHAL GMBH (DE) 2010-01-13 EP claimed
US-7541495-B2 para-alkyl-substituted N-(4-hydroxy-3-methoxy-benzyl)-cinnamamides, pharmaceutical compositions and uses thereof GRUENENTHAL GMBH (DE) 2009-06-02 US claimed
US-20070208083-A1 Alkyl-substituted N-(4-hydroxy-3-methoxy-benzyl)-cinnamamides, pharmaceutical compositions and uses thereof GRUENENTHAL GMBH (DE) 2007-09-06 US claimed
US-7541495-B2 para-alkyl-substituted N-(4-hydroxy-3-methoxy-benzyl)-cinnamamides, pharmaceutical compositions and uses thereof GRUENENTHAL GMBH (DE) 2009-06-02 US disclosed
US-20070208083-A1 Alkyl-substituted N-(4-hydroxy-3-methoxy-benzyl)-cinnamamides, pharmaceutical compositions and uses thereof GRUENENTHAL GMBH (DE) 2007-09-06 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-20070208083-A1 Alkyl-substituted N-(4-hydroxy-3-methoxy-benzyl)-cinnamamides, pharmaceutical compositions and uses thereof CES2, GAA, EGLN3 MAPT 2566/4885TYR 227/4885ACHE 2638/4885

“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.