SCHEMBL31065796

SCHEMBL31065796

Cc1nc(C2CC2c2ccc(C(=O)N(C)C3C[C@H]4CC[C@@H](C3)N4C(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)cc2Cl)c2ccsc2n1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 8/20 0.35
UCHL1 P09936 9/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.31
NPSR1 Q6W5P4 1/20 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
SCHEMBL31065763 0.83 USP30 (0.47) USP30
SCHEMBL31065776 0.82 GPR119 (0.32) USP30
SCHEMBL31065748 0.81 USP30 (0.32) USP30
SCHEMBL31065745 0.81
SCHEMBL31065809 0.81 PLD3 (0.32)
SCHEMBL31065750 0.81 GPR119 (0.32) USP30
SCHEMBL31065766 0.79 AURKA (0.32)
SCHEMBL31065803 0.78 USP30 (0.38) USP30
SCHEMBL30968142 0.78 USP30 (0.38) USP30
SCHEMBL31065780 0.77 PLD3 (0.32)

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-2024131942-A1 CYCLOPROPANE TLR7 AND TLR8 INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海深势唯思科技有限责任公司 2024-06-27 WO disclosed