SCHEMBL24764604

SCHEMBL24764604

CC(C)(C)OC(=O)N1CCN(c2ncc(F)cc2Br)C(CO)C1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.42
TRPV3 Q8NET8 2/20 0.37
NTRK1 P04629 1/20 0.37
USP30 Q70CQ3 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36

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
SCHEMBL24763869 0.90 GPR119 (0.40) GPR119USP30HDAC8HDAC6IDO1
SCHEMBL24763856 0.88 MEN1 (0.42) GPR119HDAC8HDAC6
SCHEMBL24674717 0.88 MEN1 (0.42) GPR119HDAC8HDAC6
SCHEMBL24764607 0.88 GPR119 (0.42) GPR119
SCHEMBL34471700 0.87 GPR119 (0.42) GPR119TRPV3USP30IDO1TDO2
SCHEMBL31022332 0.87 GPR119 (0.42) GPR119TRPV3USP30IDO1TDO2
SCHEMBL31022118 0.87 GPR119 (0.42) GPR119TRPV3USP30IDO1TDO2
SCHEMBL31729445 0.85 GPR119 (0.40) GPR119TRPV3USP30HDAC8HDAC6
SCHEMBL31729058 0.83 CYP3A4 (0.43) GPR119TRPV3USP30
SCHEMBL14465886 0.82 CXCR3 (0.50) GPR119HDAC6

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
WO-2022184103-A1 TRICYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 武汉誉祥医药科技有限公司 2022-09-09 WO disclosed