SCHEMBL30152969

SCHEMBL30152969

CCOc1cc(-c2ccc(F)cc2-c2nncn2C)cc(-c2nc3cc(CN[C@@H]4CCC[C@@H]4O)cc(OC)c3o2)n1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 9/20 0.33
▸ PDCD1LG2 Q9BQ51 2/20 0.33
▸ PDCD1 Q15116 3/20 0.32
▸ KCNH2 Q12809 2/20 0.31
▸ HCRTR1 O43613 2/20 0.30
▸ CCNT1 O60563 1/20 0.30
▸ CDK9 P50750 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ GRIN2B Q13224 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
SCHEMBL24818773 1.00 CD274 (0.33) CD274PDCD1LG2PDCD1KCNH2HCRTR1
SCHEMBL24819868 0.92 CD274 (0.35) CD274PDCD1LG2PDCD1KCNH2HCRTR1
SCHEMBL24819863 0.87 CD274 (0.39) CD274PDCD1LG2PDCD1KCNH2HCRTR1
SCHEMBL24820696 0.86 S1PR1 (0.32) —
SCHEMBL30152951 0.86 S1PR1 (0.32) —
SCHEMBL30152688 0.84 CBLB (0.35) CD274PDCD1LG2
SCHEMBL30153020 0.84 CBLB (0.35) CD274PDCD1LG2PDCD1
SCHEMBL24819009 0.84 CBLB (0.35) CD274PDCD1LG2
SCHEMBL24820102 0.84 CBLB (0.35) CD274PDCD1LG2PDCD1
SCHEMBL24819905 0.82 CBLB (0.41) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4359381-A1 CBL-B MODULATORS AND USES THEREOF Nimbus Clio, Inc. (US) 2024-05-01 — — EP disclosed
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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