SCHEMBL13610320

SCHEMBL13610320

C[Si](C)(C)O[Si](C)(CCCOc1ccc(-c2ccc(C#N)cc2)cc1)O[Si](C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.49
HRH2 P25021 9/20 0.49
HRH1 P35367 9/20 0.49
MMP2 P08253 4/20 0.49
MMP3 P08254 5/20 0.47
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
MMP1 P03956 1/20 0.46
MMP9 P14780 1/20 0.46
MMP13 P45452 1/20 0.46

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
SCHEMBL13610333 0.90 KDM4E (0.46) HRH3HRH2HRH1MMP2MMP3
SCHEMBL13110637 0.83 HRH3 (0.45) HRH3HRH2HRH1MMP2MMP3
SCHEMBL13860542 0.83 HRH3 (0.46) HRH3HRH2HRH1MMP2MMP3
SCHEMBL17225149 0.83 KDM4E (0.50) HRH3HRH2HRH1MMP2MMP3
SCHEMBL15045544 0.83 KDM4E (0.50) HRH3HRH2HRH1MMP2MMP3
SCHEMBL9194726 0.82 MMP2 (0.55) HRH3HRH2HRH1MMP2MMP3
SCHEMBL3027168 0.79 HRH3 (0.51) HRH3HRH2HRH1MMP2MMP3
SCHEMBL26602050 0.79 MMP3 (0.66) HRH3HRH2HRH1MMP2MMP3
SCHEMBL13610317 0.78 HRH2 (0.43) HRH2HRH1HDAC1HDAC2
SCHEMBL9194747 0.78 HRH3 (0.48) HRH3HRH2HRH1MMP2MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7623203-B2 Light modulating material FUJIFILM CORPORATION (JP) 2009-11-24 US disclosed
US-20080094551-A1 Light modulating material FUJIFILM CORPORATION 2008-04-24 US disclosed
US-20070218216-A1 Light modulating material FUJIFILM CORPORATION 2007-09-20 US disclosed