SCHEMBL24820274

SCHEMBL24820274

COCCOCCNCc1cc(OC)c2oc(-c3cccc(-c4ccc(F)cc4-c4nncn4C)c3)nc2c1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 18/20 0.41
▸ PDCD1 Q15116 10/20 0.36
▸ CD274 Q9NZQ7 10/20 0.36
▸ CLK1 P49759 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL24819921 0.96 VSIR (0.43) VSIRPDCD1CD274CLK1SMN1; SMN2
SCHEMBL30153145 0.94 VSIR (0.41) VSIRPDCD1CD274
SCHEMBL24818760 0.94 VSIR (0.41) VSIRPDCD1CD274
SCHEMBL24818954 0.93 VSIR (0.42) VSIRPDCD1CD274
SCHEMBL30153097 0.91 VSIR (0.41) VSIRPDCD1CD274CLK1SMN1; SMN2
SCHEMBL30152784 0.90 VSIR (0.40) VSIRPDCD1CD274
SCHEMBL30152638 0.89 VSIR (0.44) VSIRPDCD1CD274
SCHEMBL24818960 0.89 VSIR (0.44) VSIRPDCD1CD274
SCHEMBL24818740 0.89 VSIR (0.44) VSIRPDCD1CD274
SCHEMBL24818952 0.86 VSIR (0.41) VSIRPDCD1CD274

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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