SCHEMBL8387263

SCHEMBL8387263

CSc1c(O)ccc2c1[nH]c1ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.47
GABRP O00591 2/20 0.46
GABRD O14764 2/20 0.46
GABRA1 P14867 2/20 0.46
GABRB1 P18505 2/20 0.46
GABRG2 P18507 2/20 0.46
GABRB3 P28472 2/20 0.46
GABRA5 P31644 2/20 0.46
GABRA3 P34903 2/20 0.46
GABRA2 P47869 2/20 0.46
GABRB2 P47870 2/20 0.46
GABRA4 P48169 2/20 0.46
GABRE P78334 2/20 0.46
GABRA6 Q16445 2/20 0.46
GABRG1 Q8N1C3 2/20 0.46
GABRG3 Q99928 2/20 0.46
GABRQ Q9UN88 2/20 0.46
MPL P40238 2/20 0.43
MAPT P10636 3/20 0.42
CYP1A2 P05177 2/20 0.42

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
SCHEMBL5964419 0.77 KIF11 (0.56) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL1887694 0.77 SRC (0.61) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL30143007 0.77 SRC (0.61) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL8801909 0.75 SLC22A6 (0.48) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL8389286 0.75 MAPT (0.48) KIF11MPLMAPTALDH1A1MAPK1
SCHEMBL27578036 0.74 KIF11 (0.52) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL3874949 0.74 KIF11 (0.52) KIF11GABRPGABRDGABRA1GABRB1
Acetone SCHEMBL8600747 0.73 APP (0.55) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL191347 0.73 KIF11 (0.71) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL13563976 0.73 KIF11 (0.78) KIF11GABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5877199-A ALZHEIMER'S DISEASE; SEDATIVE SANKYO COMPANY, LIMITED (JP) 1999-03-02 US disclosed
EP-0804416-A1 HETEROCYCLIC COMPOUNDS, USEFUL AS ALLOSTERIC EFFECTORS AT MUSCARINIC RECEPTORS SANKYO COMPANY LIMITED (JP) 1997-11-05 EP disclosed
WO-1996003377-A1 HETEROCYCLIC COMPOUNDS, USEFUL AS ALLOSTERIC EFFECTORS AT MUSCARINIC RECEPTORS SANKYO COMPANY, LIMITED (JP) 1996-02-08 WO disclosed