SCHEMBL24046895

SCHEMBL24046895

N#Cc1ccc(-c2cc(=O)c3ccccc3o2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 12/20 1.00
▸ PLA2G2A P14555 3/20 0.73
▸ PLA2G4A P47712 3/20 0.73
▸ PARP1 P09874 4/20 0.69
▸ TNKS2 Q9H2K2 4/20 0.69
▸ RAB9A P51151 4/20 0.69
▸ SMN1; SMN2 Q16637 4/20 0.69
▸ AR P10275 3/20 0.69
▸ NPC1 O15118 3/20 0.69
▸ CYP3A4 P08684 3/20 0.69
▸ HPGD P15428 3/20 0.69
▸ GABRP O00591 2/20 0.69
▸ GABRD O14764 2/20 0.69
▸ GABRA1 P14867 2/20 0.69
▸ GABRB1 P18505 2/20 0.69
▸ GABRG2 P18507 2/20 0.69
▸ GABRB3 P28472 2/20 0.69
▸ GABRA5 P31644 2/20 0.69
▸ GABRA3 P34903 2/20 0.69
▸ GABRA2 P47869 2/20 0.69

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
Flavone SCHEMBL27434618 0.84 TNKS (0.96) TNKSPLA2G2APLA2G4APARP1TNKS2
Flavone SCHEMBL1660769 0.84 TNKS (0.96) TNKSPLA2G2APLA2G4APARP1TNKS2
Flavone SCHEMBL29695444 0.82 TNKS (0.93) TNKSPLA2G2APLA2G4APARP1TNKS2
SCHEMBL23070093 0.82 TNKS (0.93) TNKSPLA2G2APLA2G4APARP1TNKS2
Flavone SCHEMBL28635083 0.82 TNKS (0.93) TNKSPLA2G2APLA2G4APARP1TNKS2
Flavone SCHEMBL30542161 0.82 TNKS (1.00) TNKSPLA2G2APLA2G4APARP1TNKS2
Flavone SCHEMBL18879 0.82 TNKS (1.00) TNKSPLA2G2APLA2G4APARP1TNKS2
Flavone SCHEMBL15676601 0.82 TNKS (1.00) TNKSPLA2G2APLA2G4APARP1TNKS2
Flavone SCHEMBL31316377 0.82 TNKS (1.00) TNKSPLA2G2APLA2G4APARP1TNKS2
Flavone SCHEMBL28248986 0.82 TNKS (1.00) TNKSPLA2G2APLA2G4APARP1TNKS2

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-2021236578-A1 CHROMEN-4-ONE DERIVATIVES, SUCH AS E.G. FLAVONES, FOR USE AS CK2 INHIBITORS FOR THE TREATMENT OF NEUROINFLAMMATION SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2021-11-25 — — WO disclosed
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