SCHEMBL22100706

SCHEMBL22100706

C=C(/C=C/c1ccc(OC)cc1)N(Cc1ccccc1)c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 6/20 0.73
BCHE P06276 2/20 0.51
SNCA P37840 1/20 0.51
ACHE P22303 1/20 0.51
RNF4 P78317 1/20 0.48
G6PC1 P35575 1/20 0.48
MAOB P27338 1/20 0.47
CYP3A4 P08684 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TRPA1 O75762 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
GSK3B P49841 1/20 0.46
BACE1 P56817 1/20 0.46
PLAAT3 P53816 1/20 0.46
PLAAT5 Q96KN8 1/20 0.46

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
SCHEMBL22100701 0.85 TRPM8 (0.75) TRPM8BCHEMAOBCYP3A4NFKB1
SCHEMBL10270952 0.85 TRPM8 (1.00) TRPM8BCHESNCAACHERNF4
SCHEMBL18536909 0.74 TRPM8 (0.83) TRPM8BCHESNCAMAOBCYP3A4
SCHEMBL10270945 0.73 TRPM8 (1.00) TRPM8BCHESNCAMAOBCYP3A4
SCHEMBL10922363 0.72 RNF4 (0.69) TRPM8ACHERNF4MEN1KMT2A
SCHEMBL8614182 0.72 MAOB (0.69) TRPM8BCHEMAOBCYP3A4NFKB1
SCHEMBL22100703 0.72 TRPM8 (0.75) TRPM8BCHECYP3A4NFKB1NFKB2
SCHEMBL22100767 0.71 TRPM8 (0.53) TRPM8MAOBMEN1KMT2ALMNA
SCHEMBL20777273 0.71 TRPM8 (0.77) TRPM8BCHESNCAMAOBCYP3A4
SCHEMBL29779967 0.71 TRPM8 (0.77) TRPM8BCHESNCAMAOBCYP3A4

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-2501761-B1 USE OF PHYSIOLOGICAL COOLING ACTIVE INGREDIENTS, AND AGENTS CONTAINING SUCH ACTIVE INGREDIENTS SYMRISE AG (DE) 2020-06-17 EP disclosed