SCHEMBL22100747

SCHEMBL22100747

C=C(/C=C/c1cccc(CC)c1OC)N(c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 4/20 0.54
▸ NFE2L2 Q16236 5/20 0.42
▸ PTGER3 P43115 4/20 0.36
▸ PTGER2 P43116 4/20 0.36
▸ PTGER4 P35408 3/20 0.36
▸ TBXA2R P21731 1/20 0.36
▸ PTGDR Q13258 1/20 0.36
▸ CYP1A1 P04798 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ PTGER1 P34995 1/20 0.35
▸ TFEB P19484 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ BCHE P06276 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34

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
SCHEMBL19123945 0.72 NFE2L2 (0.44) NFE2L2CYP1A1CYP1A2MAPT
SCHEMBL15427433 0.72 NFE2L2 (0.44) NFE2L2CYP1A1CYP1A2MAPT
SCHEMBL10271038 0.70 TRPM8 (1.00) TRPM8NFE2L2CYP1A1CYP1A2CYP2D6
SCHEMBL16955328 0.70 CA1 (0.44) NFE2L2CYP1A1CYP1A2MAPTLMNA
SCHEMBL14999526 0.70 CA1 (0.41) NFE2L2CYP1A1CYP1A2MAPTLMNA
SCHEMBL7102162 0.68 CA1 (0.59) NFE2L2CYP1A2NPC1LMNARAB9A
SCHEMBL22002870 0.67 NPSR1 (0.38) TRPM8MAPTNPC1RAB9AMEN1
SCHEMBL30242804 0.67 APP (0.50) NFE2L2MAPTLMNAMEN1ALDH1A1
SCHEMBL27605144 0.66 TRPM8 (0.61) TRPM8CYP1A2CYP2D6MAPTNPC1
SCHEMBL16253604 0.66 CA1 (0.38) NFE2L2CYP1A1CYP1A2LMNAMEN1

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
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