SCHEMBL24820254

SCHEMBL24820254

C[C@H]1CCCN(Cc2cc(C(F)(F)F)c3oc(-c4cc(-c5ccccc5-c5nncn5C)cc(C5CC5)n4)nc3c2)C1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 14/20 0.41
▸ CNR2 P34972 2/20 0.36
▸ PDCD1 Q15116 1/20 0.35
▸ CD274 Q9NZQ7 1/20 0.35
▸ S1PR1 P21453 1/20 0.34
▸ S1PR3 Q99500 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PDE2A O00408 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
SCHEMBL30152715 1.00 CBLB (0.41) CBLBCNR2PDCD1CD274S1PR1
SCHEMBL30152755 1.00 CBLB (0.41) CBLBCNR2PDCD1CD274S1PR1
SCHEMBL24820255 1.00 CBLB (0.41) CBLBCNR2PDCD1CD274S1PR1
SCHEMBL29189932 1.00 CBLB (0.41) CBLBCNR2PDCD1CD274S1PR1
SCHEMBL30152918 0.93 CBLB (0.38) CBLBPDCD1CD274PDE2A
SCHEMBL24818957 0.93 CBLB (0.38) CBLBPDCD1CD274PDE2A
SCHEMBL24818788 0.90 CBLB (0.44) CBLBCNR2PDCD1CD274S1PR1
SCHEMBL24819900 0.90 CBLB (0.44) CBLBCNR2PDCD1CD274S1PR1
SCHEMBL30153015 0.90 CBLB (0.44) CBLBCNR2PDCD1CD274S1PR1
SCHEMBL30152952 0.90 CBLB (0.44) CBLBCNR2PDCD1CD274S1PR1

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
CN-117858865-A CBL-B modulators and uses thereof 林伯士克莱奥公司 2024-04-09 — — CN disclosed
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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