SCHEMBL28936616

SCHEMBL28936616

Cc1nnc(C(C)(O)C#Cc2cccc(-c3ncc4ccnc(N)c4n3)c2)o1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAP3K14 Q99558 20/20 0.47
▸ PRKD1 Q15139 2/20 0.37

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
SCHEMBL22744439 1.00 MAP3K14 (0.47) MAP3K14PRKD1
SCHEMBL29439508 1.00 MAP3K14 (0.47) MAP3K14PRKD1
SCHEMBL23870045 0.86 MAP3K14 (0.48) MAP3K14PRKD1
SCHEMBL22744152 0.86 MAP3K14 (0.48) MAP3K14PRKD1
SCHEMBL22715080 0.86 MAP3K14 (0.43) MAP3K14PRKD1
SCHEMBL22715084 0.86 MAP3K14 (0.43) MAP3K14PRKD1
SCHEMBL29439475 0.86 MAP3K14 (0.43) MAP3K14PRKD1
SCHEMBL29439598 0.84 MAP3K14 (0.51) MAP3K14
SCHEMBL22715936 0.84 MAP3K14 (0.51) MAP3K14
SCHEMBL22715259 0.82 MAP3K14 (0.58) MAP3K14PRKD1

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-114222737-A Small molecule inhibitor of NF-kB induced kinase 詹森药业有限公司 2022-03-22 — — CN claimed
CN-114222737-A Small molecule inhibitor of NF-kB induced kinase 詹森药业有限公司 2022-03-22 — — CN disclosed
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