SCHEMBL24819902

SCHEMBL24819902

Cn1cnnc1-c1cc(Cl)ccc1-c1cccc(-c2nc3cc(CN[C@@H]4CCC[C@@H]4O)cc(C(F)(F)F)c3[nH]2)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 1/20 0.34
▸ TRPV3 Q8NET8 5/20 0.32
▸ CD274 Q9NZQ7 4/20 0.32
▸ PDCD1 Q15116 2/20 0.32
▸ PDCD1LG2 Q9BQ51 1/20 0.31
▸ FNTA P49354 1/20 0.31
▸ FNTB P49356 1/20 0.31
▸ METTL3 Q86U44 1/20 0.30
▸ METTL14 Q9HCE5 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
SCHEMBL30152644 1.00 CBLB (0.34) CBLBTRPV3CD274PDCD1PDCD1LG2
SCHEMBL30152831 0.93 CBLB (0.34) CBLBTRPV3CD274PDCD1PDCD1LG2
SCHEMBL30152583 0.93 CBLB (0.34) CBLBTRPV3CD274PDCD1PDCD1LG2
SCHEMBL30152822 0.93 CBLB (0.34) CBLBTRPV3CD274PDCD1PDCD1LG2
SCHEMBL24818657 0.93 CBLB (0.34) CBLBTRPV3CD274PDCD1PDCD1LG2
SCHEMBL24818652 0.93 CBLB (0.34) CBLBTRPV3CD274PDCD1PDCD1LG2
SCHEMBL24820573 0.93 CBLB (0.34) CBLBTRPV3CD274PDCD1PDCD1LG2
SCHEMBL24819974 0.90 CBLB (0.44) CBLBTRPV3CD274PDCD1PDCD1LG2
SCHEMBL30152790 0.90 CBLB (0.44) CBLBTRPV3CD274PDCD1PDCD1LG2
SCHEMBL30152993 0.90 CBLB (0.44) CBLBTRPV3CD274PDCD1PDCD1LG2

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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