SCHEMBL8787000

SCHEMBL8787000

COc1ccc2cc(-c3cc[nH]n3)c(=O)oc2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.64
NPC1 O15118 4/20 0.60
RAB9A P51151 4/20 0.60
MAOA P21397 2/20 0.55
ALK Q9UM73 1/20 0.55
ALDH1A1 P00352 3/20 0.52
GAA P10253 3/20 0.52
HPGD P15428 3/20 0.52
TP53 P04637 3/20 0.52
KDM4E B2RXH2 2/20 0.52
MAPT P10636 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
GLA P06280 2/20 0.51
SLC16A3 O15427 1/20 0.51
MIF P14174 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
SIRT3 Q9NTG7 1/20 0.51
ERAP1 Q9NZ08 1/20 0.51

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
SCHEMBL8787461 0.87 NPC1 (0.51) MAOBNPC1RAB9AALDH1A1GAA
SCHEMBL8788360 0.81 MAOB (0.44) MAOBNPC1RAB9AMAOAALK
SCHEMBL8787830 0.80 KDM4E (0.50) MAOBNPC1RAB9AMAOAALDH1A1
SCHEMBL5921545 0.79 GPR35 (0.56) MAOBNPC1RAB9AALDH1A1GAA
SCHEMBL7116819 0.77 NPC1 (0.83) MAOBNPC1RAB9AMAOAALDH1A1
SCHEMBL5941014 0.77 MIF (0.70) MAOBNPC1RAB9AMAOAALK
SCHEMBL3148096 0.77 MAOB (0.61) MAOBNPC1RAB9AMAOAALK
SCHEMBL29427519 0.77 MIF (0.70) MAOBNPC1RAB9AMAOAALK
SCHEMBL8788290 0.77 MAOB (0.41) MAOBNPC1RAB9AALDH1A1GAA
SCHEMBL4358139 0.75 NPC1 (1.00) MAOBNPC1RAB9AMAOAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0758649-A1 Chromone derivative, process for preparing same and pharmaceutical composition Kureha Chemical Industry Co., Ltd. (JP) 1997-02-19 EP disclosed