SCHEMBL11510079

SCHEMBL11510079

O=C(O)c1coc2ccc(-c3ccccc3)cc2c1=O

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.67
PTPN1 P18031 3/20 0.61
PTPN2 P17706 2/20 0.61
TBK1 Q9UHD2 1/20 0.53
MAOA P21397 1/20 0.49
ADORA2B P29275 1/20 0.47
ACMSD Q8TDX5 3/20 0.46
HNF4A P41235 2/20 0.46
DHFR P00374 1/20 0.46
MCL1 Q07820 1/20 0.46
ACHE P22303 1/20 0.45
USP2 O75604 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL30059662 0.80 MAOB (1.00) MAOBMAOAADORA2B
SCHEMBL1253672 0.80 MAOB (1.00) MAOBMAOAADORA2B
SCHEMBL2403654 0.80 TGFBR1 (0.57) MAOBPTPN1PTPN2TBK1
SCHEMBL6720384 0.78 MAOB (0.61) MAOBMAOAACHEALDH1A1
SCHEMBL6720376 0.78 MAOB (0.61) MAOBMAOAADORA2BHNF4AACHE
SCHEMBL28990301 0.78 PTPN1 (0.64) MAOBPTPN1PTPN2TBK1ALDH1A1
SCHEMBL4576015 0.78 MAOB (0.61) MAOBPTPN1MAOAADORA2BUSP2
SCHEMBL11513004 0.78 MAOB (0.67) MAOBMAOAUSP2ALDH1A1TSHR
SCHEMBL31723115 0.78 MAOB (0.61) MAOBPTPN1MAOAALDH1A1
SCHEMBL3344909 0.78 MAOB (0.61) MAOBPTPN1TBK1MAOAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4159268-A ANTIBIOTICS, MICROBIOCIDES AMERICAN CYANAMID COMPANY (US) 1979-06-26 US disclosed