SCHEMBL16283900

SCHEMBL16283900

C[SiH2]c1ccc(N(c2ccc(-c3ccc(Br)cc3)cc2)c2ccc(-c3ccc(C#N)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.41
▸ MAOA P21397 1/20 0.41
▸ CYP19A1 P11511 1/20 0.38
▸ KIF11 P52732 3/20 0.38
▸ MMP3 P08254 1/20 0.37
▸ TSHR P16473 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ HRH3 Q9Y5N1 2/20 0.34
▸ AHR P35869 2/20 0.34
▸ NR3C1 P04150 1/20 0.34
▸ CYP2A6 P11509 2/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ ENPP2 Q13822 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32

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
SCHEMBL25546197 0.87 MAOB (0.52) MAOBMAOACYP19A1KIF11MMP3
SCHEMBL26965567 0.82 MAOB (0.57) MAOBMAOACYP19A1MMP3TSHR
SCHEMBL16282335 0.81 ALDH1A1 (0.52) MAOBMAOACYP19A1KIF11MMP3
SCHEMBL16282333 0.81 ALDH1A1 (0.52) MAOBMAOACYP19A1KIF11MMP3
SCHEMBL15683760 0.81 ALDH1A1 (0.52) MAOBMAOACYP19A1KIF11MMP3
SCHEMBL16282343 0.79 MAOB (0.41) MAOBMAOACYP19A1KIF11MMP3
SCHEMBL25544161 0.78 MMP3 (0.56) KIF11MMP3TSHRHSD17B10HRH3
SCHEMBL25543233 0.78 MMP3 (0.56) KIF11MMP3TSHRHSD17B10HRH3
SCHEMBL1773406 0.76 MAOB (0.64) MAOBMAOAKIF11MMP3TSHR
SCHEMBL15496905 0.76 MAOB (0.64) MAOBMAOAKIF11MMP3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140361259-A1 ARYLAMINE-BASED COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-12-11 — — US disclosed
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