SCHEMBL28811387

SCHEMBL28811387

COc1c(OC(N)=O)cncc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.35
ICAM1 P05362 1/20 0.32
SELE P16581 1/20 0.32
CCNC P24863 1/20 0.32
CDK8 P49336 1/20 0.32
DGAT1 O75907 1/20 0.31
F11 P03951 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
SCHEMBL29175545 0.84 UCHL1 (0.34) UCHL1DGAT1F11
SCHEMBL28811745 0.81 UCHL1 (0.34) UCHL1ICAM1SELEDGAT1F11
SCHEMBL29020404 0.80 NFE2L2 (0.35) UCHL1F11
SCHEMBL28950774 0.78 DYRK1A (0.37) UCHL1CCNCCDK8DGAT1F11
SCHEMBL28839065 0.78 F2 (0.31) UCHL1F11
SCHEMBL28811781 0.78 UCHL1 (0.36) UCHL1DGAT1
SCHEMBL28438600 0.76 UCHL1 (0.32) UCHL1
SCHEMBL24667027 0.74 UCHL1 (0.35) UCHL1
SCHEMBL29977339 0.74 UCHL1 (0.35) UCHL1
SCHEMBL28607887 0.73 UCHL1 (0.41) UCHL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114853730-B Compounds used as HPK1 kinase inhibitor, preparation method and application thereof 中国药科大学 2024-03-26 CN disclosed
CN-114853730-A Compound used as HPK1 kinase inhibitor and preparation method and application thereof 中国药科大学 2022-08-05 CN disclosed