SCHEMBL25422746

SCHEMBL25422746

Cc1ccc(S(=O)(=O)n2cc(-c3ccnc(NCC4CCN(CC(C)C)CC4)c3)c3ccncc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 8/20 0.40
▸ KCNH2 Q12809 7/20 0.40
▸ GSK3B P49841 3/20 0.40
▸ PIK3C3 Q8NEB9 7/20 0.39
▸ PRKD1 Q15139 2/20 0.38
▸ PDPK1 O15530 1/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ NAMPT P43490 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 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
SCHEMBL30461710 1.00 DYRK1A (0.40) DYRK1AKCNH2GSK3BPIK3C3PRKD1
SCHEMBL25421481 0.88 DYRK1A (0.41) DYRK1AKCNH2GSK3BPIK3C3PDPK1
SCHEMBL30461674 0.88 DYRK1A (0.41) DYRK1AKCNH2GSK3BPIK3C3PDPK1
SCHEMBL30461615 0.88 DYRK1A (0.53) DYRK1AKCNH2GSK3BPIK3C3
SCHEMBL25420888 0.88 DYRK1A (0.53) DYRK1AKCNH2GSK3BPIK3C3
SCHEMBL30461629 0.83 GPR119 (0.43) DYRK1AKCNH2GSK3BPIK3C3CYP2C9
SCHEMBL25420515 0.83 DYRK1A (0.50) DYRK1AKCNH2GSK3BPRKD1
SCHEMBL30461665 0.83 DYRK1A (0.50) DYRK1AKCNH2GSK3BPRKD1
SCHEMBL25421304 0.77 PIK3C3 (0.57) DYRK1AKCNH2GSK3BPIK3C3PDPK1
SCHEMBL25423592 0.76 DYRK1A (0.58) DYRK1AKCNH2GSK3BPIK3C3

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
EP-4444721-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS Prothena Biosciences Limited (IE) 2024-10-16 — — EP disclosed
WO-2023107722-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2023-06-15 — — WO disclosed
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