SCHEMBL5334237

SCHEMBL5334237

O=C1CNOc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.42
ADORA3 P0DMS8 3/20 0.42
AR P10275 2/20 0.42
KDM4E B2RXH2 2/20 0.42
CYP19A1 P11511 2/20 0.42
HSD17B10 Q99714 1/20 0.42
PKM P14618 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 1/20 0.39
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.37
HSD11B1 P28845 1/20 0.37
AKR1C3 P42330 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
CYP2A6 P11509 1/20 0.36
MAOA P21397 1/20 0.36

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
SCHEMBL29059112 0.75 CA12 (0.41) MAOBKDM4EPKMTSHRALDH1A1
SCHEMBL10434959 0.73 MAOB (0.41) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL379626 0.69 MAOB (0.48) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL186955 0.69
SCHEMBL30484685 0.69
Chromanone SCHEMBL29384996 0.68 MAOB (0.56) MAOBADORA3ARKDM4ECYP19A1
Formaldehyde SCHEMBL28963673 0.68 OXTR (0.45) MAOBTSHRCA12CA9MAOA
Chromanone SCHEMBL28794 0.68 MAOB (0.56) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL8309834 0.68 MAOB (0.40) MAOBADORA3ARKDM4ECYP19A1
3-Coumaranone SCHEMBL69412 0.67 PKM (0.56) MAOBADORA3ARKDM4ECYP19A1

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300665-B1 Cephalosporin compounds, process for their preparation and their pharmaceutical compositions ZENECA PHARMA SA (FR) 1995-12-20 EP claimed
EP-0304155-B1 Cephalosporin compounds, process for their preparation and their pharmaceutical compositions ZENECA PHARMA SA (FR) 1995-11-15 EP claimed
EP-0225182-B1 CEPHALOSPORIN COMPOUNDS ICI PHARMA (FR) 1993-02-10 EP claimed
US-5013731-A Bactericides ICI PHARMA (FR) 1991-05-07 US claimed
US-5008258-A Antibiotics I.C.I.-PHARMA (FR) 1991-04-16 US claimed
EP-0164944-B1 CEPHALOSPORIN DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-07-11 EP claimed
EP-0225182-A2 Cephalosporin compounds ICI PHARMA (FR) 1987-06-10 EP claimed
EP-0164944-A1 Cephalosporin derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-12-18 EP claimed
CN-101031565-B Substituted 2H-1, 3-benzoxazin-4 (3H) -ones PORTOLA PHARM INC 2010-09-29 CN disclosed
CN-101031565-A Substituted 2H-1, 3-benzoxazin-4 (3H) -ones PORTOLA PHARM INC (US) 2007-09-05 CN disclosed
EP-1812429-A2 SUBSTITUTED 2H-1,3-BENZOXAZIN-4(3H)-ONES Portola Pharmaceuticals, Inc. (US) 2007-08-01 EP disclosed
US-7205296-B2 Substituted 2H-1,3-benzoxazin-4(3H)-ones PORTOLA PHARMACEUTICALS, INC. (US) 2007-04-17 US disclosed
WO-2006039212-A3 SUBSTITUTED 2H-1,3-BENZOXAZIN-4(3H)-ONES PORTOLA PHARM INC (US) 2007-01-25 WO disclosed
WO-2006039212-A2 SUBSTITUTED 2H-1,3-BENZOXAZIN-4(3H)-ONES PORTOLA PHARMACEUTICALS, INC. (US) 2006-04-13 WO disclosed
US-5008258-A Antibiotics I.C.I.-PHARMA (FR) 1991-04-16 US disclosed
EP-0164944-B1 CEPHALOSPORIN DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-07-11 EP disclosed
EP-0304155-A2 Cephalosporin compounds, process for their preparation and their pharmaceutical compositions ZENECA Pharma S.A. (FR) 1989-02-22 EP disclosed
EP-0225182-A2 Cephalosporin compounds ICI PHARMA (FR) 1987-06-10 EP disclosed
EP-0224385-A2 Intermediates for the preparation of beta-lactam antibiotics IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-06-03 EP disclosed
EP-0164944-A1 Cephalosporin derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-12-18 EP disclosed