SCHEMBL3244642

SCHEMBL3244642

CN(C)C(=O)c1coc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.53
KDM4E B2RXH2 1/20 0.49
GLA P06280 1/20 0.49
PSMB5 P28074 1/20 0.48
MAOA P21397 2/20 0.46
ALDH1A1 P00352 2/20 0.46
ADORA2B P29275 1/20 0.45
MAPT P10636 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
GAA P10253 2/20 0.44
HPGD P15428 2/20 0.44
PKM P14618 1/20 0.44
CYP1A2 P05177 1/20 0.44
TSHR P16473 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TP53 P04637 1/20 0.44
IDO1 P14902 1/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL7674934 0.83 MAOB (0.47) MAOBMAOAALDH1A1ADORA2BMAPT
SCHEMBL23320363 0.81 MAOB (0.51) MAOBMAOAALDH1A1ADORA2BMAPT
SCHEMBL6119708 0.81 HPGD (0.47) MAOBMAOAALDH1A1ADORA2BMAPT
SCHEMBL1299217 0.79 MAOB (0.58) MAOBMAOAALDH1A1ADORA2BMAPT
SCHEMBL5158448 0.79 MAOB (0.49) MAOBPSMB5MAOAADORA2BMAPT
SCHEMBL8761733 0.79 MAOB (0.61) MAOBMAOAADORA2BMAPTNPC1
SCHEMBL28856330 0.79 GAA (0.74) MAOBMAOAALDH1A1MAPTGAA
SCHEMBL11884086 0.78 MAOB (0.66) MAOBMAOAADORA2BKMT2A
SCHEMBL70456 0.77 MAOB (0.76) MAOBMAOAALDH1A1ADORA2BMAPT
SCHEMBL6835355 0.77 ALDH1A1 (0.55) MAOBALDH1A1MAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106604919-B Crystal form of 6- ((6, 7-dimethoxyquinazolin-4-yl) oxy) -N, 2-dimethylbenzofuran-3-carboxamide 和记黄埔医药(上海)有限公司 2019-11-15 CN disclosed
CN-106604919-A Crystal form of 6- ((6, 7-dimethoxyquinazolin-4-yl) oxy) -N, 2-dimethylbenzofuran-3-carboxamide 和记黄埔医药(上海)有限公司 2017-04-26 CN disclosed
WO-2015057963-A1 FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO disclosed
WO-2010025138-A2 PYRIMIDINE COMPOUNDS HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2010-03-04 WO disclosed