SCHEMBL22100710

SCHEMBL22100710

C=C(CCc1ccc(CC)cc1)N(c1ccccn1)C1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 9/20 0.60
NPC1 O15118 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 4/20 0.47
LMNA P02545 4/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GAA P10253 1/20 0.44
THRB P10828 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL22100758 0.84 NPC1 (0.56) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL22100829 0.79 TRPM8 (0.60) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL10271044 0.75 TRPM8 (1.00) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL14822016 0.71 TRPM8 (0.69) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL10914231 0.70 NPC1 (0.66) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL15276661 0.68 TRPM8 (0.64) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL14821807 0.68 TRPM8 (0.61) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL14822030 0.68 ALDH1A1 (0.52) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL22100766 0.67 TRPM8 (0.55) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL14822012 0.67 TRPM8 (0.60) TRPM8NPC1SMN1; SMN2ALDH1A1LMNA

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