SCHEMBL5010156

SCHEMBL5010156

c1ccc(-c2cccc([C](Cc3cccc4ccccc34)c3cccc(-c4ccccc4)c3-c3ccccc3)c2-c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.52
CHRNA4 P43681 2/20 0.52
TDP1 Q9NUW8 2/20 0.49
MCL1 Q07820 5/20 0.46
BAD Q92934 5/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
PTGER4 P35408 1/20 0.44
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
MAPT P10636 2/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL5011002 0.86 PDCD1 (0.43) CHRNB2CHRNA4MCL1BADL3MBTL1
SCHEMBL5013873 0.79 TDP1 (0.58) TDP1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL5008840 0.78 HNF4A (0.44) CHRNB2CHRNA4MEN1KMT2ASMN1; SMN2
SCHEMBL5010021 0.76 MAPT (0.49) CHRNB2CHRNA4TDP1MCL1L3MBTL1
SCHEMBL5008902 0.73 HNF4A (0.43) CHRNB2CHRNA4L3MBTL1MEN1KMT2A
SCHEMBL5010784 0.73 TDP1 (0.56) TDP1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL17435206 0.73 TDP1 (0.70) TDP1L3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL5008897 0.73 HNF4A (0.46) CHRNB2CHRNA4L3MBTL1MEN1KMT2A
SCHEMBL7274909 0.72 CHRNB2 (0.51) CHRNB2CHRNA4TDP1MCL1BAD
SCHEMBL5011024 0.72 TDP1 (0.63) TDP1L3MBTL1MEN1KMT2ASMN1; SMN2

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-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed