SCHEMBL30968006

SCHEMBL30968006

Cc1nc(C2CC2c2ccc(C(=O)N(C)C3C[C@H]4CC[C@@H](C3)N4C(=O)OC(C)(C)C)cc2Cl)c2cccnc2n1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.36
KCNK3 O14649 5/20 0.34
KCNK9 Q9NPC2 5/20 0.34
USP30 Q70CQ3 1/20 0.33
FNTA P49354 2/20 0.32
FNTB P49356 2/20 0.32
SUV39H2 Q9H5I1 1/20 0.32
AURKA O14965 1/20 0.32
CDK2 P24941 1/20 0.32
P2RX7 Q99572 2/20 0.31

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
SCHEMBL31065774 1.00 GPR119 (0.36) GPR119KCNK3KCNK9USP30FNTA
SCHEMBL31065803 0.89 USP30 (0.38) GPR119USP30SUV39H2
SCHEMBL30968142 0.89 USP30 (0.38) GPR119USP30SUV39H2
SCHEMBL30968105 0.83 POLB (0.32)
SCHEMBL30968109 0.82 USP30 (0.39) GPR119USP30SUV39H2
SCHEMBL31065785 0.82 USP30 (0.39) GPR119USP30SUV39H2
SCHEMBL31065776 0.77 GPR119 (0.32) GPR119USP30
SCHEMBL30967972 0.76 DHODH (0.37)
SCHEMBL30968008 0.76 GPR119 (0.34) GPR119USP30SUV39H2AURKACDK2
SCHEMBL30968073 0.76 GPR119 (0.34) GPR119USP30SUV39H2AURKACDK2

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-118239959-A Cyclopropane TLR7 and 8 inhibitor and preparation method and application thereof 上海深势唯思科技有限责任公司 2024-06-25 CN disclosed