SCHEMBL24005916

SCHEMBL24005916

Cc1cc2cc[nH]c2nc1NC1CC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ULK1 O75385 4/20 0.43
▸ ADORA1 P30542 2/20 0.42
▸ IRAK4 Q9NWZ3 5/20 0.42
▸ HPGDS O60760 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.40
▸ ADORA2A P29274 1/20 0.40
▸ ADORA2B P29275 1/20 0.40
▸ BRD4 O60885 3/20 0.39
▸ ATAD2 Q6PL18 3/20 0.39
▸ JAK2 O60674 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CLK4 Q9HAZ1 1/20 0.37
▸ PAK4 O96013 1/20 0.36
▸ SYK P43405 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
SCHEMBL25625964 0.80 ULK1 (0.48) ULK1ADORA1IRAK4HPGDSADORA3
SCHEMBL24005917 0.75 GSK3A (0.48) ALDH1A1
SCHEMBL19654314 0.74 ULK1 (0.71) ULK1IRAK4SYK
SCHEMBL11286572 0.71 AXL (0.39) ADORA1IRAK4ADORA2ABRD4CLK4
SCHEMBL24005750 0.71 PIK3C3 (0.46) IRAK4ADORA3ALDH1A1CLK4PAK4
SCHEMBL24005740 0.70 JAK3 (0.41) IRAK4BRD4JAK2MAPK1
SCHEMBL19654322 0.70 ULK1 (0.72) ULK1SYK
SCHEMBL19654316 0.69 ULK1 (0.71) ULK1IRAK4BRD4MAPK1SYK
SCHEMBL9887640 0.68 AXL (0.42) ADORA1IRAK4ADORA2ABRD4CLK4
SCHEMBL24005741 0.68 RIPK1 (0.42) ADORA1IRAK4ADORA2ABRD4CLK4

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
WO-2021223736-A1 COMPOUNDS AS BCL-2 INHIBITORS FOCHON PHARMACEUTICALS, LTD. (CN) 2021-11-11 — — WO disclosed
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