SCHEMBL31105900

SCHEMBL31105900

Cc1ccc2c(cnn2C2CCCCO2)c1NC(=O)c1cnc(Nc2cccc(CC(=O)N3CCCC3)n2)s1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 8/20 0.46
▸ HCK P08631 7/20 0.44
▸ LCK P06239 10/20 0.43
▸ ABL1 P00519 1/20 0.39
▸ SRC P12931 1/20 0.39

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
SCHEMBL31105895 0.92 LCK (0.44) BTKHCKLCKABL1SRC
SCHEMBL31105865 0.85 LCK (0.46) BTKHCKLCKABL1SRC
SCHEMBL31105905 0.82 MAPK14 (0.41) BTKHCKLCKABL1SRC
SCHEMBL31105863 0.81 HCK (0.45) BTKHCKLCKABL1
SCHEMBL31105912 0.80 MAPK14 (0.50) BTKHCKLCKSRC
SCHEMBL31105942 0.80 LCK (0.42) BTKHCKLCKABL1SRC
SCHEMBL31105890 0.80 BTK (0.47) BTKHCKLCKABL1SRC
SCHEMBL31106019 0.79 LCK (0.45) BTKHCKLCKABL1SRC
SCHEMBL31106051 0.79 MAPK14 (0.46) BTKHCKLCKABL1SRC
SCHEMBL31705188 0.78 LCK (0.52) HCKLCKABL1SRC

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
WO-2024184520-A1 BIARYLAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF PROLIFERATIVE DISORDERS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-09-12 — — WO disclosed
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