SCHEMBL28809189

SCHEMBL28809189

O=Cc1n[nH]c2ccc(-c3cccnc3F)cc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 7/20 0.53
▸ CLK2 P49760 2/20 0.46
▸ CLK3 P49761 1/20 0.46
▸ MAPT P10636 2/20 0.45
▸ WNT1 P04628 3/20 0.44
▸ PIM1 P11309 2/20 0.42
▸ PIM2 Q9P1W9 1/20 0.42
▸ CYP11B2 P19099 1/20 0.40
▸ METAP2 P50579 2/20 0.40
▸ NTRK1 P04629 4/20 0.39
▸ NTRK3 Q16288 4/20 0.39
▸ NTRK2 Q16620 4/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ JAK1 P23458 1/20 0.39
▸ TYK2 P29597 1/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ DHODH Q02127 1/20 0.38
▸ PRMT5 O14744 1/20 0.37
▸ WDR77 Q9BQA1 1/20 0.37
▸ PLK4 O00444 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
SCHEMBL29754098 0.79 DYRK1A (0.67) DYRK1ACLK2CLK3MAPTWNT1
SCHEMBL23534215 0.79 DYRK1A (0.67) DYRK1ACLK2CLK3MAPTWNT1
SCHEMBL13183137 0.76 JAK2 (0.44) DYRK1ACLK2WNT1JAK2TYK2
SCHEMBL13183135 0.76 DYRK1A (0.47) DYRK1AWNT1CYP11B2JAK2MAP4K4
SCHEMBL13183156 0.75 JAK2 (0.61) DYRK1ACLK2CLK3MAPTNTRK3
SCHEMBL31472533 0.74 TRPA1 (0.52) MAPTJAK2JAK1TYK2JAK3
SCHEMBL25419245 0.74 TRPA1 (0.52) MAPTJAK2JAK1TYK2JAK3
SCHEMBL3540306 0.73 ITK (0.43) METAP2NTRK1NTRK3NTRK2
SCHEMBL23533911 0.72 DYRK1A (0.59) DYRK1ACLK2CLK3WNT1
SCHEMBL23533877 0.72 DYRK1A (0.70) DYRK1ACLK2CLK3WNT1

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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