SCHEMBL24818905

SCHEMBL24818905

Cn1cnnc1-c1cc(F)ccc1-c1cccc(-c2nc3cc(CNS(C)(=O)=O)cc(C(F)(F)F)c3o2)c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 3/20 0.36
▸ CBLB Q13191 4/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ S1PR1 P21453 6/20 0.33
▸ S1PR3 Q99500 5/20 0.33
▸ CETP P11597 2/20 0.33
▸ HPGD P15428 1/20 0.32
▸ P2RX7 Q99572 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
SCHEMBL24819018 0.88 VSIR (0.40) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL24819924 0.88 VSIR (0.37) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL24820056 0.88 VSIR (0.41) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL30152823 0.88 VSIR (0.41) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL24820456 0.87 VSIR (0.43) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL30153193 0.87 VSIR (0.42) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL30152605 0.87 VSIR (0.43) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL24818922 0.87 VSIR (0.42) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL24818928 0.87 VSIR (0.43) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL24820345 0.87 S1PR1 (0.41) VSIRCBLBS1PR1S1PR3CETP

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
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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