SCHEMBL8628828

SCHEMBL8628828

NC(=O)c1coc2cc(O)c(O)cc2c1=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALOX12 P18054 2/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ MAOB P27338 10/20 0.42
▸ MAOA P21397 3/20 0.42
▸ ADORA2B P29275 1/20 0.42
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PTPN1 P18031 2/20 0.39
▸ MMP1 P03956 1/20 0.39
▸ FASN P49327 1/20 0.39
▸ ACE P12821 1/20 0.38
▸ SIRT1 Q96EB6 1/20 0.38
▸ MIF P14174 1/20 0.37
▸ XDH P47989 1/20 0.37

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
SCHEMBL10517674 0.84 MAOB (0.57) ALOX12ALOX15MAOBMAOAADORA2B
SCHEMBL8315659 0.83 ALOX12 (0.50) ALOX12ALOX15MAOBMAOAADORA2B
Hydrochloric Acid SCHEMBL10516530 0.83 MAOB (0.56) ALOX12ALOX15MAOBMAOAADORA2B
SCHEMBL8628824 0.83 ALOX12 (0.50) ALOX12ALOX15MAOBMAOAADORA2B
SCHEMBL17855977 0.77 NPC1 (0.51) MAOBMAOANPC1MAPTRAB9A
SCHEMBL30643087 0.76 MAOB (0.64) MAOBMAOANPC1MAPT
SCHEMBL4974849 0.74 MAOB (0.72) MAOBMAOAADORA2BNPC1MAPT
SCHEMBL30643084 0.74 MAOB (0.72) MAOBMAOAADORA2BNPC1MAPT
SCHEMBL16446088 0.73 ALOX12 (0.54) ALOX12ALOX15MAOBMAOANPC1
SCHEMBL8122069 0.73 MAOB (0.48) ALOX12ALOX15MAOBMAOAADORA2B

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-5801242-A Process for making quinolonyl lactam antimicrobials and novel intermediate compounds THE PROCTER & GAMBLE COMPANY (US) 1998-09-01 — — US disclosed
US-5703231-A Process for making antimicrobial compounds THE PROCTER & GAMBLE COMPANY (US) 1997-12-30 — — US disclosed
CN-1158120-A Process for the preparation of antimicrobial compounds PROCTER & GAMBLE (US) 1997-08-27 — — CN disclosed
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