SCHEMBL28066043

SCHEMBL28066043

Nc1c(O)cc(O)c2c(=O)cc(-c3ccccc3)oc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 4/20 0.65
GABRD O14764 4/20 0.65
GABRA1 P14867 4/20 0.65
GABRB1 P18505 4/20 0.65
GABRG2 P18507 4/20 0.65
GABRB3 P28472 4/20 0.65
GABRA5 P31644 4/20 0.65
GABRA3 P34903 4/20 0.65
GABRA2 P47869 4/20 0.65
GABRB2 P47870 4/20 0.65
GABRA4 P48169 4/20 0.65
GABRE P78334 4/20 0.65
GABRA6 Q16445 4/20 0.65
GABRG1 Q8N1C3 4/20 0.65
GABRG3 Q99928 4/20 0.65
GABRQ Q9UN88 4/20 0.65
CCNC P24863 3/20 0.65
CDK8 P49336 3/20 0.65
PTGS2 P35354 2/20 0.65
PKM P14618 2/20 0.65

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
Norwogonin SCHEMBL30485998 0.85 GABRP (0.68) GABRPGABRDGABRA1GABRB1GABRG2
Norwogonin SCHEMBL760431 0.85 GABRP (0.68) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL21145431 0.83 GABRP (0.62) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8934562 0.82 MEN1 (0.67) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29149073 0.82 GABRP (0.70) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4783697 0.81 ALDH1A1 (0.67) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL27719536 0.80 PPARG (0.68) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL31632309 0.79 CYP19A1 (0.74) PKMABCB1CYP1A1CYP1A2CYP1B1
SCHEMBL28461887 0.79 CYP19A1 (0.74) PKMABCB1CYP1A1CYP1A2CYP1B1
Wogonin SCHEMBL29632729 0.79 GABRP (1.00) GABRPGABRDGABRA1GABRB1GABRG2

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
CN-105669625-A 2-substituted benzopyran-4-one compounds and application thereof 中国人民解放军第二军医大学 2016-06-15 CN claimed
CN-105669625-B A kind of 2- substitution chromene -4- ketone compounds and its application 中国人民解放军第二军医大学 2018-05-25 CN disclosed
CN-105669625-A 2-substituted benzopyran-4-one compounds and application thereof 中国人民解放军第二军医大学 2016-06-15 CN disclosed