SCHEMBL24820324

SCHEMBL24820324

COCCNCc1cc(C2CC2)c2oc(-c3cccc(-c4ccc(F)cc4-c4nncn4C)c3)nc2c1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 18/20 0.41
▸ PDCD1 Q15116 13/20 0.38
▸ CD274 Q9NZQ7 13/20 0.38
▸ CBLB Q13191 1/20 0.33

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
SCHEMBL30152555 1.00 VSIR (0.41) VSIRPDCD1CD274CBLB
SCHEMBL24819921 0.90 VSIR (0.43) VSIRPDCD1CD274
SCHEMBL24818960 0.90 VSIR (0.44) VSIRPDCD1CD274
SCHEMBL30152638 0.90 VSIR (0.44) VSIRPDCD1CD274
SCHEMBL24818740 0.90 VSIR (0.44) VSIRPDCD1CD274
SCHEMBL30152612 0.89 VSIR (0.40) VSIRPDCD1CD274CBLB
SCHEMBL24818947 0.89 VSIR (0.40) VSIRPDCD1CD274CBLB
SCHEMBL24819883 0.87 VSIR (0.42) VSIRPDCD1CD274CBLB
SCHEMBL24818912 0.86 VSIR (0.39) VSIRPDCD1CD274CBLB
SCHEMBL30152682 0.86 VSIR (0.39) VSIRPDCD1CD274CBLB

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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