SCHEMBL8309834

SCHEMBL8309834

O=C1CC[C]Oc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.40
ADORA3 P0DMS8 3/20 0.40
AR P10275 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP19A1 P11511 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAOA P21397 3/20 0.38
PKM P14618 1/20 0.38
TSHR P16473 1/20 0.38
CYP2A6 P11509 1/20 0.38
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
MAPT P10636 2/20 0.35
HSD11B1 P28845 1/20 0.35
AKR1C3 P42330 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
GRM5 P41594 1/20 0.34
ALOX15 P16050 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL224107 0.80 MAOB (0.42) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL124208 0.71 MAOA (0.39) MAOBMAOATSHR
Chromanone SCHEMBL28794 0.69 MAOB (0.56) MAOBADORA3ARKDM4ECYP19A1
Chromanone SCHEMBL29384996 0.69 MAOB (0.56) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL5334237 0.68 MAOB (0.42) MAOBADORA3ARKDM4ECYP19A1
Chromanone SCHEMBL29349977 0.68 MAOB (0.55) MAOBADORA3ARKDM4ECYP19A1
Chromanone SCHEMBL28463260 0.68 MAOB (0.55) MAOBADORA3ARKDM4ECYP19A1
Chromanone SCHEMBL28719460 0.68 MAOB (0.55) MAOBADORA3ARKDM4ECYP19A1
Chromanone SCHEMBL30017864 0.68 MAOB (0.55) MAOBADORA3ARKDM4ECYP19A1
Chromanone SCHEMBL7617916 0.68 MAOB (0.55) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998033382-A1 FUNGICIDAL COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-08-06 WO claimed
WO-1998023155-A1 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-06-04 WO claimed
EP-0825992-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-03-04 EP claimed
WO-1996036633-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-11-21 WO claimed
EP-0934283-A2 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-08-11 EP disclosed
WO-1999011129-A1 ENANTIOMERICALLY ENRICHED COMPOSITIONS AND THEIR PESTICIDAL USE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-03-11 WO disclosed
WO-1998033382-A1 FUNGICIDAL COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-08-06 WO disclosed
WO-1998023155-A1 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-06-04 WO disclosed
EP-0836384-A1 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-04-22 EP disclosed
WO-1998005652-A2 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-02-12 WO disclosed