SCHEMBL6508968

SCHEMBL6508968

C[Si](C)(C)Cc1ccc(COCCCc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.57
TDP1 Q9NUW8 1/20 0.57
HRH3 Q9Y5N1 3/20 0.49
HRH4 Q9H3N8 2/20 0.49
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
IDO1 P14902 1/20 0.44
TSHR P16473 1/20 0.44
KCNH2 Q12809 1/20 0.43
ESR1 P03372 1/20 0.43
LTA4H P09960 1/20 0.41
EPHX2 P34913 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
SCHEMBL6507494 0.90 L3MBTL1 (0.49) L3MBTL1TDP1HRH3HRH4TSHR
SCHEMBL6506604 0.84 TSHR (0.62) L3MBTL1TDP1IDO1TSHRESR1
SCHEMBL4069939 0.84 TDP1 (0.64) L3MBTL1TDP1HRH3HRH4MEN1
SCHEMBL13825175 0.81 KCNH2 (0.62) L3MBTL1TDP1HRH3HRH4MEN1
SCHEMBL6510053 0.81 KCNH2 (0.62) L3MBTL1TDP1HRH3HRH4MEN1
SCHEMBL3438748 0.81 TDP1 (0.60) L3MBTL1TDP1HRH3HRH4MEN1
SCHEMBL1839074 0.80 TDP1 (0.59) L3MBTL1TDP1HRH3HRH4IDO1
SCHEMBL19210361 0.79 L3MBTL1 (0.88) L3MBTL1TDP1MEN1KMT2ALTA4H
SCHEMBL4664895 0.78 TDP1 (0.58) L3MBTL1TDP1HRH3HRH4MEN1
SCHEMBL13570654 0.78 L3MBTL1 (0.58) L3MBTL1TDP1HRH3HRH4MEN1

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