SCHEMBL6507494

SCHEMBL6507494

C[Si](C)(C)Cc1ccc(COCCc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
TSHR P16473 1/20 0.47
ESR1 P03372 1/20 0.46
HRH4 Q9H3N8 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
KCNH2 Q12809 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LTA4H P09960 1/20 0.40
NAAA Q02083 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
HCAR2 Q8TDS4 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL6508968 0.90 L3MBTL1 (0.57) L3MBTL1TDP1TSHRESR1HRH4
SCHEMBL6506604 0.87 TSHR (0.62) L3MBTL1TDP1TSHRESR1ALDH1A1
SCHEMBL1066576 0.83 TSHR (0.67) L3MBTL1TDP1TSHRESR1HRH4
Hydrochloric Acid SCHEMBL1409425 0.81 TSHR (0.64) L3MBTL1TDP1TSHRESR1HRH4
Water SCHEMBL28780406 0.81 TSHR (0.64) L3MBTL1TDP1TSHRESR1HRH4
SCHEMBL14458204 0.80 TP53 (0.54) L3MBTL1TDP1TSHRESR1KCNH2
SCHEMBL430043 0.79 ESR1 (0.62) L3MBTL1TDP1TSHRESR1KCNH2
SCHEMBL28716976 0.78 TSHR (0.54) L3MBTL1TDP1TSHRHRH4HRH3
SCHEMBL1837574 0.78 ESR1 (0.54) L3MBTL1TDP1TSHRESR1
SCHEMBL6744772 0.78 ESR1 (0.54) L3MBTL1TDP1TSHRESR1

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-2005100329-A1 NOVEL PROTECTING REAGENTS, PROTECTING GROUPS AND METHODS OF FORMING AND USING THE SAME THE UNIVERSITY OF MISSISSIPI (US) 2005-10-27 WO disclosed