SCHEMBL28643274

SCHEMBL28643274

NC(=O)OCC1CCN(c2ccc(F)cc2C=O)C1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 2/20 0.41
CHRM3 P20309 14/20 0.41
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
RBP4 P02753 3/20 0.40
TTR P02766 3/20 0.40

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
SCHEMBL28643265 0.93 HDAC3 (0.39) RPS6KB1CHRM3
SCHEMBL28653059 0.82 CHRM3 (0.40) RPS6KB1CHRM3LPLLIPGRBP4
SCHEMBL28642501 0.82 CHRM3 (0.40) RPS6KB1CHRM3LPLLIPGRBP4
SCHEMBL28647415 0.81 RBP4 (0.38) RPS6KB1CHRM3LPLLIPGRBP4
SCHEMBL28653069 0.81 RBP4 (0.38) RPS6KB1CHRM3LPLLIPGRBP4
SCHEMBL28647418 0.81 RBP4 (0.38) RPS6KB1CHRM3LPLLIPGRBP4
SCHEMBL28653070 0.81 RBP4 (0.38) RPS6KB1CHRM3LPLLIPGRBP4
SCHEMBL2557591 0.80 FFAR4 (0.41) RPS6KB1LPLLIPG
SCHEMBL28659709 0.80 CHRM3 (0.34) CHRM3
SCHEMBL22781025 0.77 BPTF (0.48) LPLLIPG

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-113527298-A Macrocyclic lactam derivative, preparation method and application thereof 浙江海正药业股份有限公司 2021-10-22 CN disclosed