SCHEMBL29190033

SCHEMBL29190033

Cn1cnnc1-c1c(-c2ccccc2)ccc(F)c1-c1nc2cc(CNC3CCCC3O)cc(C(F)F)c2o1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 9/20 0.33
▸ PDCD1LG2 Q9BQ51 1/20 0.32
▸ VSIR Q9H7M9 2/20 0.31
▸ PDCD1 Q15116 1/20 0.30
▸ HTR3A P46098 1/20 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
SCHEMBL29190035 1.00 CD274 (0.33) CD274PDCD1LG2VSIRPDCD1HTR3A
SCHEMBL29190053 0.92 CD274 (0.35) CD274PDCD1LG2VSIRPDCD1LTA4H
SCHEMBL29190054 0.92 CD274 (0.35) CD274PDCD1LG2VSIRPDCD1LTA4H
SCHEMBL29190045 0.90 CD274 (0.34) CD274PDCD1LG2VSIRPDCD1LTA4H
SCHEMBL29189877 0.90 CD274 (0.34) CD274PDCD1LG2VSIRPDCD1LTA4H
SCHEMBL29189879 0.90 CD274 (0.34) CD274PDCD1LG2VSIRPDCD1LTA4H
SCHEMBL29190040 0.90 CD274 (0.34) CD274PDCD1LG2VSIRPDCD1LTA4H
SCHEMBL29189974 0.90 CD274 (0.34) CD274PDCD1LG2VSIRPDCD1LTA4H
SCHEMBL29189971 0.90 CD274 (0.34) CD274PDCD1LG2VSIRPDCD1LTA4H
SCHEMBL29190065 0.89 CD274 (0.33) 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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