SCHEMBL28686102

SCHEMBL28686102

O=C(O)N1CC(O)C(CNC(=O)N2CCc3ccccc3[C@@H]2c2ccc(F)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 4/20 0.54
TRPM8 Q7Z2W7 11/20 0.52
KCNH2 Q12809 1/20 0.49
HHAT Q5VTY9 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
SCHEMBL28686100 1.00 CHRM3 (0.54) CHRM3TRPM8KCNH2HHAT
SCHEMBL29561137 0.89 CHRM3 (0.57) CHRM3TRPM8KCNH2HHAT
SCHEMBL22776338 0.89 CHRM3 (0.57) CHRM3TRPM8KCNH2HHAT
SCHEMBL22776336 0.89 CHRM3 (0.57) CHRM3TRPM8KCNH2HHAT
SCHEMBL22776994 0.88 TRPM8 (0.50) CHRM3TRPM8KCNH2
SCHEMBL22776992 0.88 TRPM8 (0.50) CHRM3TRPM8KCNH2
SCHEMBL30965926 0.88 TRPM8 (0.50) CHRM3TRPM8KCNH2
SCHEMBL22776993 0.88 TRPM8 (0.50) CHRM3TRPM8KCNH2
SCHEMBL22776218 0.84 TRPM8 (0.55) CHRM3TRPM8KCNH2
SCHEMBL22784205 0.84 TRPM8 (0.55) CHRM3TRPM8KCNH2

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-113950477-A Modulators of progranulin and methods of use thereof 阿库达医疗公司 2022-01-18 CN disclosed