SCHEMBL11274659

SCHEMBL11274659

CCN(CC)C(=O)/C=C/c1ccc(C)c(C)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 4/20 0.63
NPC1 O15118 2/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
BCHE P06276 1/20 0.53
MAOA P21397 1/20 0.53
ACHE P22303 1/20 0.53
MAOB P27338 1/20 0.53
APP P05067 4/20 0.50
LTB4R Q15722 1/20 0.48
LTB4R2 Q9NPC1 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
HSP90AA1 P07900 1/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP3A4 P08684 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL11274662 1.00 TRPM8 (0.63) TRPM8NPC1L3MBTL1BCHEMAOA
SCHEMBL28501196 0.81 NPC1 (0.72) TRPM8NPC1L3MBTL1BCHEMAOA
SCHEMBL11279078 0.79 NPC1 (0.59) TRPM8NPC1L3MBTL1BCHEMAOA
SCHEMBL11279073 0.79 NPC1 (0.59) TRPM8NPC1L3MBTL1BCHEMAOA
SCHEMBL28508248 0.79 NPC1 (0.69) TRPM8NPC1L3MBTL1BCHEMAOA
SCHEMBL31228779 0.78 NPC1 (0.72) TRPM8NPC1L3MBTL1BCHEMAOA
SCHEMBL31228704 0.78 NPC1 (0.72) TRPM8NPC1L3MBTL1BCHEMAOA
SCHEMBL10270783 0.78 TRPM8 (1.00) TRPM8NPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL28408661 0.78 TRPM8 (1.00) TRPM8NPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL7245709 0.77 L3MBTL1 (0.70) TRPM8NPC1L3MBTL1BCHEMAOA

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
US-4335054-A Process for the preparation of alkenylbenzenecarboxylic acid derivatives and alkenylnaphthalenecarboxylic acid derivatives CIBA-GEIGY CORPORATION (US) 1982-06-15 US disclosed