SCHEMBL28809218

SCHEMBL28809218

CC(C)(C)OC(=O)NOC1CCC(NC(=O)c2c[nH]c3ccc(-c4cccnc4F)cc23)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 5/20 0.50
▸ WNT1 P04628 4/20 0.50
▸ BACE1 P56817 1/20 0.44
▸ HTR4 Q13639 2/20 0.41
▸ KDM1A O60341 2/20 0.39
▸ BTK Q06187 4/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ALOX5AP P20292 1/20 0.38
▸ FEN1 P39748 1/20 0.38
▸ GSK3B P49841 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ NR4A2 P43354 1/20 0.36
▸ MAP4K4 O95819 1/20 0.36

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
SCHEMBL28810225 0.89 DYRK1A (0.48) DYRK1AWNT1BACE1HTR4KDM1A
SCHEMBL28810222 0.89 DYRK1A (0.48) DYRK1AWNT1BACE1HTR4KDM1A
SCHEMBL23534247 0.87 WNT1 (0.54) DYRK1AWNT1BACE1BTKALDH1A1
SCHEMBL28810288 0.84 KDM1A (0.51) DYRK1AWNT1BACE1HTR4KDM1A
SCHEMBL28809212 0.84 KDM1A (0.51) DYRK1AWNT1BACE1HTR4KDM1A
SCHEMBL29753995 0.84 KDM1A (0.51) DYRK1AWNT1BACE1HTR4KDM1A
SCHEMBL28809213 0.84 KDM1A (0.51) DYRK1AWNT1BACE1HTR4KDM1A
SCHEMBL28811002 0.84 DYRK1A (0.51) DYRK1AWNT1BACE1HTR4KDM1A
SCHEMBL28811003 0.84 DYRK1A (0.51) DYRK1AWNT1BACE1HTR4KDM1A
SCHEMBL28809202 0.82 BACE1 (0.60) DYRK1AWNT1BACE1HTR4ALDH1A1

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
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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