SCHEMBL4885718

SCHEMBL4885718

CC(C)(C)O[SiH2]CCCNC(=O)CBr

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HDAC3 O15379 2/20 0.34
HDAC4 P56524 2/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC7 Q8WUI4 2/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC10 Q969S8 2/20 0.34
HDAC11 Q96DB2 2/20 0.34
HDAC8 Q9BY41 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
HDAC9 Q9UKV0 2/20 0.34
HDAC5 Q9UQL6 2/20 0.34
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.32
ADORA1 P30542 2/20 0.31
FAAH O00519 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL28025402 0.79 MAOA (0.37) MEN1KMT2ATDP1GAA
SCHEMBL19611966 0.72 TDP1 (0.64) MEN1KMT2ATDP1GAA
SCHEMBL7242095 0.72 TDP1 (0.59) MEN1KMT2ATDP1GAA
SCHEMBL14536293 0.71 TDP1 (0.67) MEN1KMT2ATDP1GAA
SCHEMBL3871437 0.71 TDP1 (0.67) MEN1KMT2ATDP1GAA
SCHEMBL4882043 0.71 KMT2A (0.36) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL16853220 0.71 ALDH1A1 (0.55) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL16853223 0.71 ALDH1A1 (0.48) MEN1KMT2AHDAC3HDAC4HDAC1
SCHEMBL11905643 0.70 LTA4H (0.35) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29177627 0.70 EPHX2 (0.50) MEN1KMT2AHDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050032084-A1 Method of attaching a biopolymer to a solid support DUKE UNIVERSITY (US) 2005-02-10 US claimed
US-20020076832-A1 Method of attaching a biopolymer to a solid support DUKE UNIVERSITY 2002-06-20 US claimed
US-20080070803-A1 Electrochemical Treatment Of Substrates EGELAND RYAN D 2008-03-20 US disclosed
EP-1682259-A1 ELECTROCHEMICAL TREATMENT OF SUBSTRATES OXFORD GENE TECHNOLOGY IP LIMITED (GB) 2006-07-26 EP disclosed
WO-2005037425-A1 ELECTROCHEMICAL TREATMENT OF SUBSTRATES OXFORD GENE TECHNOLOGY IP LIMITED (GB) 2005-04-28 WO disclosed
US-20050032084-A1 Method of attaching a biopolymer to a solid support DUKE UNIVERSITY (US) 2005-02-10 US disclosed
US-20020076832-A1 Method of attaching a biopolymer to a solid support DUKE UNIVERSITY 2002-06-20 US disclosed