SCHEMBL30968544

SCHEMBL30968544

CC(C)(C)OC(=O)N1CC2CNCC(c3ccc4c(c3)OC[C@H](N)C4)(C1)C2(F)F

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.33
JAK1 P23458 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
NR1H2 P55055 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
SCHEMBL30060095 0.76 GPR183 (0.38) RORCNR1H2
SCHEMBL20731532 0.76 GPR183 (0.38) RORCNR1H2
SCHEMBL30059985 0.74 PDK2 (0.37) DDB1CRBNNR1H2
SCHEMBL20723048 0.74 PDK2 (0.37) DDB1CRBNNR1H2
SCHEMBL20723043 0.74 PDK2 (0.37) DDB1CRBNNR1H2
SCHEMBL30968555 0.74 KDM1A (0.31) DDB1CRBN
SCHEMBL20731008 0.68 MAPT (0.48)
SCHEMBL30061346 0.68 MAPT (0.48)
SCHEMBL20722608 0.68 MAPT (0.48)
SCHEMBL20722615 0.67 ABHD6 (0.43) NR1H2

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-112867712-B Carboxamide as ubiquitin-specific protease inhibitor 瓦洛早期发现股份有限公司 2024-07-16 CN disclosed