SCHEMBL24819850

SCHEMBL24819850

Cn1cnnc1-c1cc(F)ccc1-c1cccc(-c2nc3cc(CNCC4(O)CC4)cc(C(F)(F)F)c3o2)c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ VSIR Q9H7M9 10/20 0.39
▸ CBLB Q13191 2/20 0.39
▸ PDCD1 Q15116 4/20 0.32
▸ CD274 Q9NZQ7 4/20 0.32
▸ S1PR1 P21453 5/20 0.31
▸ S1PR3 Q99500 5/20 0.31
▸ CETP P11597 1/20 0.31
▸ HPGD P15428 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
SCHEMBL24818681 0.97 CBLB (0.41) VSIRCBLBPDCD1CD274S1PR1
SCHEMBL24819853 0.97 CBLB (0.40) VSIRCBLBPDCD1CD274S1PR1
SCHEMBL24819885 0.94 VSIR (0.39) VSIRCBLBPDCD1CD274S1PR1
SCHEMBL30153023 0.94 VSIR (0.38) VSIRCBLBPDCD1CD274S1PR1
SCHEMBL24818799 0.94 VSIR (0.38) VSIRCBLBPDCD1CD274S1PR1
SCHEMBL24820562 0.91 CBLB (0.48) VSIRCBLBPDCD1CD274
SCHEMBL24820495 0.91 CBLB (0.41) VSIRCBLBPDCD1CD274
SCHEMBL30153196 0.91 CBLB (0.35) VSIRCBLBS1PR1S1PR3CETP
SCHEMBL24820051 0.90 CBLB (0.41) VSIRCBLBPDCD1CD274
SCHEMBL24821815 0.90 CBLB (0.38) 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
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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