SCHEMBL29190065

SCHEMBL29190065

Cn1cnnc1-c1c(-c2ccccc2)ccc(F)c1-c1nc2cc(CNC3CCC[C@H]3O)cc(C(C)(C)C)c2o1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 10/20 0.33
▸ PDCD1LG2 Q9BQ51 1/20 0.32
▸ VSIR Q9H7M9 2/20 0.31
▸ PDCD1 Q15116 2/20 0.31
▸ S1PR1 P21453 3/20 0.31
▸ S1PR3 Q99500 3/20 0.31
▸ TRPV3 Q8NET8 2/20 0.30
▸ LTA4H P09960 2/20 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
SCHEMBL29190064 1.00 CD274 (0.33) CD274PDCD1LG2VSIRPDCD1S1PR1
SCHEMBL29190124 0.95 CD274 (0.33) CD274PDCD1LG2VSIRPDCD1S1PR1
SCHEMBL29190125 0.95 CD274 (0.33) CD274PDCD1LG2VSIRPDCD1S1PR1
SCHEMBL29190090 0.93 CD274 (0.35) CD274PDCD1S1PR1S1PR3TRPV3
SCHEMBL29190092 0.93 CD274 (0.35) CD274PDCD1S1PR1S1PR3TRPV3
SCHEMBL29190054 0.92 CD274 (0.35) CD274PDCD1LG2VSIRPDCD1TRPV3
SCHEMBL29190053 0.92 CD274 (0.35) CD274PDCD1LG2VSIRPDCD1TRPV3
SCHEMBL29189879 0.90 CD274 (0.34) CD274PDCD1LG2VSIRPDCD1TRPV3
SCHEMBL29189877 0.90 CD274 (0.34) CD274PDCD1LG2VSIRPDCD1TRPV3
SCHEMBL29190045 0.90 CD274 (0.34) CD274PDCD1LG2VSIRPDCD1LTA4H

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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