SCHEMBL8867903

SCHEMBL8867903

CCOC(=O)c1cccnc1CC[Si](C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
HTT P42858 1/20 0.49
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
BRD4 O60885 1/20 0.44
GAA P10253 1/20 0.43
USP2 O75604 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPK1 P28482 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C19 P33261 1/20 0.42
ELANE P08246 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TP53 P04637 1/20 0.41

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
SCHEMBL8200687 0.87 TSHR (0.56) TSHRHTTALDH1A1HSD17B10L3MBTL1
SCHEMBL844745 0.83 TSHR (0.59) TSHRHTTALDH1A1HSD17B10L3MBTL1
SCHEMBL16616136 0.83 TSHR (0.51) TSHRHTTALDH1A1HSD17B10L3MBTL1
SCHEMBL28066682 0.83 TSHR (0.51) TSHRHTTALDH1A1HSD17B10L3MBTL1
SCHEMBL1542171 0.82 TSHR (0.58) TSHRHTTALDH1A1HSD17B10L3MBTL1
SCHEMBL29570791 0.82 TSHR (0.58) TSHRHTTALDH1A1HSD17B10L3MBTL1
SCHEMBL6417736 0.82 L3MBTL1 (0.56) TSHRHTTALDH1A1HSD17B10L3MBTL1
SCHEMBL8126448 0.82 TSHR (0.50) TSHRHTTALDH1A1HSD17B10L3MBTL1
SCHEMBL15131223 0.81 TSHR (0.56) TSHRHTTALDH1A1HSD17B10L3MBTL1
SCHEMBL4034951 0.81 TSHR (0.56) TSHRHTTALDH1A1HSD17B10L3MBTL1

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-5670456-A Compounds SANDOZ LTD. (CH) 1997-09-23 US disclosed