SCHEMBL30152878

SCHEMBL30152878

Cn1cnnc1-c1cc(F)ccc1-c1cccc(-c2nc3cc(CN[C@@H]4CC[C@H]4O)cc(C(F)(F)F)c3o2)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 6/20 0.36
▸ CBLB Q13191 4/20 0.34
▸ S1PR1 P21453 9/20 0.33
▸ S1PR3 Q99500 6/20 0.33
▸ PDCD1 Q15116 2/20 0.33
▸ CD274 Q9NZQ7 2/20 0.33
▸ CETP P11597 1/20 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
SCHEMBL24818668 1.00 VSIR (0.36) VSIRCBLBS1PR1S1PR3PDCD1
SCHEMBL30153112 1.00 VSIR (0.36) VSIRCBLBS1PR1S1PR3PDCD1
SCHEMBL24818931 1.00 VSIR (0.36) VSIRCBLBS1PR1S1PR3PDCD1
SCHEMBL24820029 0.97 VSIR (0.35) VSIRCBLBS1PR1S1PR3PDCD1
SCHEMBL24818917 0.97 VSIR (0.35) VSIRCBLBS1PR1S1PR3PDCD1
SCHEMBL24818891 0.97 VSIR (0.35) VSIRCBLBS1PR1S1PR3PDCD1
SCHEMBL24820025 0.97 VSIR (0.35) VSIRCBLBS1PR1S1PR3PDCD1
SCHEMBL24818680 0.97 VSIR (0.35) VSIRCBLBS1PR1S1PR3PDCD1
SCHEMBL24820761 0.97 VSIR (0.35) VSIRCBLBS1PR1S1PR3PDCD1
SCHEMBL24820063 0.93 VSIR (0.35) VSIRCBLBPDCD1CD274

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4359381-A1 CBL-B MODULATORS AND USES THEREOF Nimbus Clio, Inc. (US) 2024-05-01 — — EP disclosed
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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