SCHEMBL30337490

SCHEMBL30337490

COC(C(N)=O)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
EPHX1 P07099 2/20 0.43
GLS O94925 6/20 0.42
GPR139 Q6DWJ6 1/20 0.42

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
SCHEMBL29392091 0.87 GPR139 (0.46) TRPM8GLSGPR139
SCHEMBL17295978 0.87 GPR139 (0.46) TRPM8GLSGPR139
SCHEMBL29017154 0.87 GPR139 (0.46) TRPM8GLSGPR139
SCHEMBL29543522 0.83 L3MBTL1 (0.63) TRPM8L3MBTL1
SCHEMBL27649238 0.82 TRPM8 (0.49) TRPM8L3MBTL1EPHX1GPR139
SCHEMBL7470004 0.79 TRPM8 (0.49) TRPM8EPHX1GPR139
SCHEMBL31177417 0.77 GPR139 (0.45) TRPM8EPHX1GPR139
SCHEMBL12895271 0.77 L3MBTL1 (0.68) TRPM8L3MBTL1EPHX1GPR139
SCHEMBL17761208 0.76 PLA2G10 (0.53) TRPM8L3MBTL1EPHX1GPR139
SCHEMBL12895166 0.76 PLA2G10 (0.53) TRPM8L3MBTL1EPHX1GPR139

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
CN-115594683-A Glutaminase GLS1 inhibitor and preparation method and application thereof 杭州禹胜医药科技有限公司(CN) 2023-01-13 CN disclosed