SCHEMBL30401951

SCHEMBL30401951

N#Cc1cccc(-c2cc(-c3cn(Cc4cccc(N5CCC[C@@H]5C(=O)O)n4)nn3)cc(N)n2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 1/20 0.37
▸ SYK P43405 1/20 0.37
▸ UCHL1 P09936 2/20 0.37
▸ USP30 Q70CQ3 1/20 0.37
▸ CYP19A1 P11511 1/20 0.35
▸ CDC7 O00311 1/20 0.35
▸ DAPK3 O43293 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ PAK4 O96013 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ CSNK1A1 P48729 1/20 0.35
▸ CDK8 P49336 1/20 0.35
▸ CLK2 P49760 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ CDK7 P50613 1/20 0.35
▸ CDK9 P50750 1/20 0.35
▸ PRKX P51817 1/20 0.35
▸ CDK5 Q00535 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35

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
SCHEMBL20421936 1.00 KLKB1 (0.37) KLKB1SYKUCHL1USP30CYP19A1
SCHEMBL20417078 1.00 KLKB1 (0.37) KLKB1SYKUCHL1USP30CYP19A1
SCHEMBL20416628 0.90 ADORA2A (0.42) SYKUCHL1USP30HSD11B1ADORA2A
SCHEMBL30401359 0.90 ADORA2A (0.42) SYKUCHL1USP30HSD11B1ADORA2A
SCHEMBL20401505 0.90 ADORA2A (0.42) SYKUCHL1USP30HSD11B1ADORA2A
SCHEMBL30401055 0.90 ADORA2A (0.42) SYKUCHL1USP30HSD11B1ADORA2A
SCHEMBL20401512 0.90 ADORA2A (0.42) SYKUCHL1USP30HSD11B1ADORA2A
SCHEMBL20416822 0.88 ADORA2A (0.42) SYKUCHL1USP30ADORA2AADORA1
SCHEMBL30401142 0.88 ADORA2A (0.42) SYKUCHL1USP30ADORA2AADORA1
SCHEMBL20401302 0.87 PDE4D (0.47) KLKB1CYP19A1CDC7DAPK3ROCK2

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-116768859-A Azolopyrimidines for the treatment of cancer related disorders 艾库斯生物科学有限公司 2023-09-19 — — CN disclosed
CN-110214012-B Azolopyrimidines for the treatment of cancer related disorders 艾库斯生物科学有限公司 2023-05-09 — — CN disclosed
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