SCHEMBL7786832

SCHEMBL7786832

BrCCC(COC1CCCCO1)(COC1CCCCO1)COC1CCCCO1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4C Q9H3R0 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL23449055 0.85 MEN1 (0.35) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL3078865 0.78 MEN1 (0.38) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL31646759 0.77 MEN1 (0.43) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL7365931 0.77 MEN1 (0.43) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL8570584 0.77 MEN1 (0.40) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL57544 0.77 MEN1 (0.43) MEN1KMT2AKDM4CL3MBTL1NPC1
SCHEMBL3283714 0.77 MEN1 (0.34) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL2627743 0.77
SCHEMBL187033 0.76 MEN1 (0.36) MEN1KMT2AKDM4CNPC1RAB9A
SCHEMBL4713156 0.75 MEN1 (0.34) MEN1KMT2AKDM4CL3MBTL1NPC1

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
US-6251898-B1 Medical use of fluorenone derivatives for treating and preventing brain and spinal injury QUESTCOR PHARMACEUTICALS, INC. 2001-06-26 US disclosed
WO-2001014334-A1 FLUORENONE COMPOUNDS WITH MODIFIED 7-POSITION SUBSTITUENTS FOR TREATING AND PREVENTING BRAIN AND SPINAL INJURY QUESTCOR PHARMACEUTICALS, INC. (US) 2001-03-01 WO disclosed