SCHEMBL8788229

SCHEMBL8788229

O=c1cc(-c2ccc[nH]2)oc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 8/20 0.58
PARP1 P09874 5/20 0.58
TNKS2 Q9H2K2 5/20 0.58
GABRP O00591 5/20 0.58
GABRD O14764 5/20 0.58
GABRA1 P14867 5/20 0.58
GABRB1 P18505 5/20 0.58
GABRG2 P18507 5/20 0.58
GABRB3 P28472 5/20 0.58
GABRA5 P31644 5/20 0.58
GABRA3 P34903 5/20 0.58
GABRA2 P47869 5/20 0.58
GABRB2 P47870 5/20 0.58
GABRA4 P48169 5/20 0.58
GABRE P78334 5/20 0.58
GABRA6 Q16445 5/20 0.58
GABRG1 Q8N1C3 5/20 0.58
GABRG3 Q99928 5/20 0.58
GABRQ Q9UN88 5/20 0.58
NPC1 O15118 4/20 0.58

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
SCHEMBL8787065 0.81 MAOB (0.53) TNKSPARP1TNKS2GABRPGABRD
SCHEMBL17843529 0.76 NPC1 (0.56) NPC1HPGDRAB9ACA1CA2
Flavone SCHEMBL28248986 0.74 TNKS (1.00) TNKSPARP1TNKS2GABRPGABRD
Flavone SCHEMBL30542161 0.74 TNKS (1.00) TNKSPARP1TNKS2GABRPGABRD
Flavone SCHEMBL15676601 0.74 TNKS (1.00) TNKSPARP1TNKS2GABRPGABRD
Flavone SCHEMBL31316377 0.74 TNKS (1.00) TNKSPARP1TNKS2GABRPGABRD
Flavone SCHEMBL18879 0.74 TNKS (1.00) TNKSPARP1TNKS2GABRPGABRD
SCHEMBL8787800 0.74 TNKS (0.54) TNKSPARP1TNKS2GABRPGABRD
SCHEMBL8787377 0.73 TNKS (0.66) TNKSPARP1TNKS2GABRPGABRD
Flavone SCHEMBL3090011 0.73 TNKS (0.96) TNKSPARP1TNKS2GABRPGABRD

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9110864-A None JP disclosed
US-5698575-A Chromone compounds, pharmaceutical compositions containing the same, and use of the same KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1997-12-16 US disclosed
CN-1148593-A Production method for chromone derivative and its medicinal composition KUREHA CHEMICAL IND CO LTD (JP) 1997-04-30 CN disclosed
JP-H09110864-A CHROMONE DERIVATIVE, ITS PRODUCTION AND MEDICINE COMPOSITION KUREHA CHEM IND CO LTD 1997-04-28 JP disclosed
EP-0758649-A1 Chromone derivative, process for preparing same and pharmaceutical composition Kureha Chemical Industry Co., Ltd. (JP) 1997-02-19 EP disclosed