SCHEMBL8029201

SCHEMBL8029201

[c]1ccc(-c2ccc(C=Cc3ccccc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.48
NFE2L2 Q16236 2/20 0.48
CYP19A1 P11511 2/20 0.48
MAOA P21397 2/20 0.48
CA1 P00915 1/20 0.45
MGLL Q99685 1/20 0.45
RELA Q04206 3/20 0.43
TRPA1 O75762 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HDAC2 Q92769 2/20 0.41
CHAT P28329 1/20 0.40
PTPN1 P18031 1/20 0.40
HNF4A P41235 1/20 0.40
HDAC1 Q13547 2/20 0.39
HDAC6 Q9UBN7 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39

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
SCHEMBL4074475 0.88 MAOB (0.54) MAOBNFE2L2CYP19A1MAOARELA
SCHEMBL210538 0.85 MAOB (0.52) MAOBNFE2L2CYP19A1MAOARELA
SCHEMBL920604 0.85 MAOB (0.52) MAOBNFE2L2CYP19A1MAOARELA
SCHEMBL48799 0.85 MAOB (0.52) MAOBNFE2L2CYP19A1MAOARELA
SCHEMBL11548871 0.85 MAOB (0.62) MAOBNFE2L2CYP19A1MAOACA1
SCHEMBL83380 0.85 MAOB (0.62) MAOBNFE2L2CYP19A1MAOACA1
SCHEMBL11548873 0.85 MAOB (0.62) MAOBNFE2L2CYP19A1MAOACA1
SCHEMBL83379 0.85 MAOB (0.62) MAOBNFE2L2CYP19A1MAOACA1
SCHEMBL28048995 0.83 MAOB (0.50) MAOBNFE2L2CYP19A1MAOARELA
SCHEMBL11548255 0.83 CA1 (0.60) MAOBNFE2L2CYP19A1MAOACA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104678725-B Toner 佳能株式会社 2018-11-20 CN disclosed
WO-2000070371-A2 LATERAL LIGHT EMITTING FIBER OPTIC CABLE WITH IMPROVED LIGHT OUTPUT OPTIC-TECH INTERNATIONAL CORP. (US) 2000-11-23 WO disclosed