SCHEMBL18399199

SCHEMBL18399199

CC(C)(C)OC(=O)N1CC[C@@H](c2cc3c(cnn3C3CCCCO3)cc2F)[C@@H](F)C1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 7/20 0.40
▸ TRPV3 Q8NET8 3/20 0.39
▸ RXRA P19793 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ RXRG P48443 1/20 0.39
▸ CCNK O75909 1/20 0.38
▸ CDK12 Q9NYV4 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ SCN9A Q15858 1/20 0.36
▸ USP30 Q70CQ3 1/20 0.36
▸ PDE4B Q07343 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35

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
SCHEMBL22873547 1.00 GPR119 (0.40) GPR119TRPV3RXRARXRBRXRG
SCHEMBL28610193 1.00 GPR119 (0.40) GPR119TRPV3RXRARXRBRXRG
SCHEMBL28610255 0.93 LRRK2 (0.40) GPR119RXRARXRBRXRGCCNK
SCHEMBL18398983 0.93 LRRK2 (0.40) GPR119RXRARXRBRXRGCCNK
SCHEMBL20437352 0.93 LRRK2 (0.40) GPR119RXRARXRBRXRGCCNK
SCHEMBL31084394 0.92 GPR119 (0.39) GPR119RXRARXRBRXRGCCNK
SCHEMBL18399288 0.92 TRPV3 (0.41) GPR119TRPV3RXRARXRBRXRG
SCHEMBL21796877 0.92 TRPV3 (0.41) GPR119TRPV3RXRARXRBRXRG
SCHEMBL28608598 0.92 TRPV3 (0.41) GPR119TRPV3RXRARXRBRXRG
SCHEMBL21796835 0.87 RXRA (0.45) GPR119RXRARXRBRXRG

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3325449-A1 COMPOUNDS GlaxoSmithKline Intellectual Property Development Limited (GB) 2018-05-30 — — EP disclosed
WO-2017012576-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-01-26 — — WO disclosed
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