SCHEMBL24820547

SCHEMBL24820547

Cc1cc(CN[C@@H]2CCCC2O[Si](C)(C)C(C)(C)C)cc2nc(-c3cccc(-c4ccc(F)cc4-c4nncn4C)c3)oc12

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 1/20 0.33
▸ HPGD P15428 1/20 0.31
▸ PDCD1 Q15116 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31
▸ CBLB Q13191 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30
▸ CETP P11597 1/20 0.30

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
SCHEMBL30153066 1.00 VSIR (0.33) VSIRHPGDPDCD1CD274CBLB
SCHEMBL24821940 0.94 VSIR (0.32) VSIRPDCD1CD274
SCHEMBL30152806 0.94 VSIR (0.32) VSIRPDCD1CD274
SCHEMBL30152798 0.93 CBLB (0.33) VSIRCBLB
SCHEMBL24820556 0.93 KCNH2 (0.35) VSIRPDCD1CD274KCNH2
SCHEMBL30153133 0.93 KCNH2 (0.35) VSIRPDCD1CD274KCNH2
SCHEMBL24820059 0.93 CBLB (0.33) VSIRCBLB
SCHEMBL24820787 0.90 VSIR (0.31) VSIR
SCHEMBL30152732 0.90 VSIR (0.31) VSIR
SCHEMBL24820311 0.87 VSIR (0.37) VSIRHPGDPDCD1CD274CBLB

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-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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