SCHEMBL1794338

SCHEMBL1794338

CCCCCCCC1(CCCCCCC)c2ccccc2-c2cccc(Br)c21.[MgH2].[MgH2]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.38
MMP9 P14780 3/20 0.38
MMP8 P22894 2/20 0.38
MMP13 P45452 2/20 0.38
RECQL P46063 2/20 0.35
PDK2 Q15119 3/20 0.34
APEX1 P27695 1/20 0.34
PDE7A Q13946 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
NPC1 O15118 1/20 0.33
MITF O75030 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL27923635 0.98 MMP2 (0.38) MMP2MMP9MMP8MMP13RECQL
SCHEMBL3202110 0.98 MMP2 (0.38) MMP2MMP9MMP8MMP13RECQL
SCHEMBL27517960 0.98 MMP2 (0.38) MMP2MMP9MMP8MMP13RECQL
SCHEMBL31531016 0.98 MMP2 (0.38) MMP2MMP9MMP8MMP13RECQL
SCHEMBL27630363 0.98 MMP2 (0.38) MMP2MMP9MMP8MMP13RECQL
SCHEMBL27942749 0.98 MMP2 (0.38) MMP2MMP9MMP8MMP13RECQL
SCHEMBL28205809 0.98 MMP2 (0.38) MMP2MMP9MMP8MMP13RECQL
SCHEMBL27735142 0.92 APEX1 (0.37) MMP2MMP9MMP8MMP13RECQL
SCHEMBL27614932 0.86 PDE7A (0.41) PDK2APEX1PDE7AGRM2
SCHEMBL4454321 0.86 MMP2 (0.42) MMP2MMP9MMP8MMP13RECQL

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-7951874-B2 Non-conjugated polymeric perarylated boranes, use thereof as organically semiconductor transmitters and/or transport materials, methods for producing same and uses thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2011-05-31 US disclosed
US-20060229431-A1 Non-conjugated polymeric perarylated boranes, use thereof as organically semiconductor transmitters and/or transport materials, methods for producing same and uses thereof OSRAM OLED GMBH (DE) 2006-10-12 US disclosed