SCHEMBL16213419

SCHEMBL16213419

COC[C@H](CO[Si](C)(C)C(C)(C)C)N(Cc1ccccc1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 2/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
RIPK1 Q13546 2/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA3 P07451 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34

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
SCHEMBL16213420 1.00 MEN1 (0.40) MEN1KMT2AL3MBTL1POLBALDH1A1
SCHEMBL16213520 0.89 MEN1 (0.40) MEN1KMT2AL3MBTL1POLBALDH1A1
SCHEMBL16213178 0.87 MEN1 (0.43) MEN1KMT2AL3MBTL1POLBALDH1A1
SCHEMBL16213179 0.87 MEN1 (0.43) MEN1KMT2AL3MBTL1POLBALDH1A1
SCHEMBL1733842 0.81 MEN1 (0.40) MEN1KMT2AL3MBTL1POLBALDH1A1
SCHEMBL15530276 0.76 TSHR (0.38) MEN1KMT2AL3MBTL1POLBALDH1A1
SCHEMBL31335359 0.75 KMT2A (0.41) MEN1KMT2AL3MBTL1POLBALDH1A1
SCHEMBL26132032 0.75 KMT2A (0.41) MEN1KMT2AL3MBTL1POLBALDH1A1
SCHEMBL30613681 0.75 KMT2A (0.41) MEN1KMT2AL3MBTL1POLBALDH1A1
SCHEMBL21080314 0.75 EPOR (0.46) MEN1KMT2AL3MBTL1POLBALDH1A1

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
WO-2014178082-A1 NOVEL 2'/3'/5'-(R/S)-SERINYL FUNCTIONALIZED OLIGONUCLEOTIDES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2014-11-06 WO claimed