SCHEMBL29190015

SCHEMBL29190015

Cn1cnnc1-c1c(-c2ccccc2)ccc(F)c1-c1nc2cc(CNCC3(O)CCC3)cc(C3CC3)c2o1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 1/20 0.35
▸ VSIR Q9H7M9 8/20 0.34
▸ CD274 Q9NZQ7 4/20 0.31
▸ PDCD1 Q15116 3/20 0.31

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
SCHEMBL29190119 0.92 VSIR (0.36) CBLBVSIRCD274PDCD1
SCHEMBL29190080 0.90 VSIR (0.36) CBLBVSIRCD274PDCD1
SCHEMBL29189987 0.86 PDCD1 (0.33) CBLBVSIRCD274PDCD1
SCHEMBL29190022 0.85 VSIR (0.36) VSIRCD274PDCD1
SCHEMBL29190086 0.85 CD274 (0.34) VSIRCD274PDCD1
SCHEMBL29190118 0.85 CBLB (0.38) CBLB
SCHEMBL24820576 0.85 CBLB (0.39) CBLBVSIRCD274PDCD1
SCHEMBL30153210 0.85 CBLB (0.39) CBLBVSIRCD274PDCD1
SCHEMBL29189974 0.84 CD274 (0.34) VSIRCD274PDCD1
SCHEMBL29189971 0.84 CD274 (0.34) VSIRCD274PDCD1

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
CN-117858865-A CBL-B modulators and uses thereof 林伯士克莱奥公司 2024-04-09 — — CN disclosed
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