SCHEMBL9887136

SCHEMBL9887136

NC1=C2CCCCC2CCC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 7/20 0.32
NOS2 P35228 7/20 0.32
NOS3 P29474 5/20 0.32
HRH2 P25021 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL22664403 0.87
SCHEMBL15865750 0.79
SCHEMBL28614043 0.78 KDM4E (0.36) KDM4EPOLBL3MBTL1
SCHEMBL11739358 0.78 KDM4E (0.36) KDM4EPOLBL3MBTL1
SCHEMBL59379 0.75 KDM4E (0.37) NOS1NOS2NOS3KDM4EPOLB
SCHEMBL28611125 0.70 KDM4E (0.31) KDM4EPOLBL3MBTL1
SCHEMBL28617319 0.70 KDM4E (0.31) KDM4EPOLBL3MBTL1
SCHEMBL28615932 0.70 KDM4E (0.31) KDM4EPOLBL3MBTL1
SCHEMBL20346087 0.69 THRB (0.36) NOS1NOS2NOS3KDM4EPOLB
SCHEMBL20345644 0.69 THRB (0.36) NOS1NOS2NOS3KDM4EPOLB

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
WO-2012073541-A1 BENZO[c]CARBAZOLE COMPOUND HAVING PYRIDINE-CONTAINING SUBSTITUENT AND ORGANIC ELECTROLUMINESCENT ELEMENT JNC株式会社 (JP) 2012-06-07 WO disclosed
WO-2011068204-A1 BENZO[C]CARBAZOLE COMPOUND THAT HAS SUBSTITUENT BEARING PYRIDINE RING, AND ORGANIC ELECTROLUMINESCENT ELEMENT JNC株式会社 (JP) 2011-06-09 WO disclosed