SCHEMBL8637159

SCHEMBL8637159

COc1ccc(/C=C/C(=O)Nc2ccccc2C(N)=O)c(OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.59
TRPM8 Q7Z2W7 1/20 0.59
ALDH1A1 P00352 8/20 0.56
MEN1 O00255 8/20 0.56
KMT2A Q03164 8/20 0.56
HPGD P15428 7/20 0.56
KDM4E B2RXH2 7/20 0.56
SMN1; SMN2 Q16637 6/20 0.56
NPC1 O15118 5/20 0.56
RAB9A P51151 5/20 0.56
TP53 P04637 3/20 0.56
NPSR1 Q6W5P4 3/20 0.56
LMNA P02545 3/20 0.56
CYP3A4 P08684 3/20 0.56
HIF1A Q16665 2/20 0.56
GAA P10253 2/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C19 P33261 2/20 0.56
CYP2C9 P11712 1/20 0.56
HSD17B10 Q99714 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
SCHEMBL8637166 1.00 TRPA1 (0.59) TRPA1TRPM8ALDH1A1MEN1KMT2A
SCHEMBL8635621 0.91 TRPA1 (0.65) TRPA1TRPM8ALDH1A1MEN1KMT2A
SCHEMBL8635625 0.91 TRPA1 (0.65) TRPA1TRPM8ALDH1A1MEN1KMT2A
SCHEMBL13320675 0.89 TRPA1 (0.74) TRPA1TRPM8ALDH1A1MEN1KMT2A
SCHEMBL8641477 0.85 TRPA1 (0.79) TRPA1TRPM8ALDH1A1MEN1KMT2A
SCHEMBL8641484 0.85 TRPA1 (0.79) TRPA1TRPM8ALDH1A1MEN1KMT2A
SCHEMBL13352116 0.84 MMP1 (0.56) TRPA1TRPM8ALDH1A1HPGDKDM4E
SCHEMBL8638797 0.83 TRPA1 (0.61) TRPA1TRPM8ALDH1A1MEN1KMT2A
SCHEMBL8638792 0.83 TRPA1 (0.61) TRPA1TRPM8ALDH1A1MEN1KMT2A
SCHEMBL14319169 0.83 TRPA1 (0.55) TRPA1TRPM8ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0855387-A1 2-ACYLAMINOBENZAMIDE DERIVATIVES AND PREVENTIVE AND REMEDY FOR DISEASES CAUSED BY THE SUPERMULTIPLICATION OF VASCULAR INTIMAL CELLS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1998-07-29 EP disclosed