SCHEMBL28810208

SCHEMBL28810208

CC(C)(C)OC(=O)N1CCC(NC(=O)c2n[nH]c3ccc(-c4ccccc4F)cc23)CC1

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 18/20 0.75
▸ WNT1 P04628 13/20 0.75
▸ GSK3B P49841 2/20 0.59
▸ KCNH2 Q12809 2/20 0.59

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
SCHEMBL29753965 1.00 DYRK1A (0.75) DYRK1AWNT1GSK3BKCNH2
SCHEMBL23533897 0.90 DYRK1A (0.74) DYRK1AWNT1GSK3BKCNH2
SCHEMBL29754004 0.90 DYRK1A (0.74) DYRK1AWNT1GSK3BKCNH2
SCHEMBL23534403 0.87 DYRK1A (0.81) DYRK1AWNT1GSK3BKCNH2
SCHEMBL17095507 0.86 DYRK1A (1.00) DYRK1AWNT1GSK3BKCNH2
SCHEMBL23533913 0.85 DYRK1A (0.60) DYRK1AWNT1GSK3B
SCHEMBL23534341 0.85 DYRK1A (0.69) DYRK1AWNT1
SCHEMBL5945731 0.84 NPC1 (0.63) DYRK1A
SCHEMBL29753913 0.83 DYRK1A (0.77) DYRK1AWNT1
SCHEMBL28809200 0.83 DYRK1A (0.77) DYRK1AWNT1

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-114867718-A Novel indazole derivative and use thereof 韩国化学研究院 2022-08-05 — — CN claimed
CN-114867718-A Novel indazole derivative and use thereof 韩国化学研究院 2022-08-05 — — CN disclosed
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