SCHEMBL6676922

SCHEMBL6676922

C=C(c1ccc(C(=O)OC)cc1)c1cc2c(cc1C)[Si](C)(C)CC[Si]2(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
RXRA P19793 4/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
RXRB P28702 2/20 0.43
RXRG P48443 2/20 0.43
MEN1 O00255 1/20 0.43
CYP26A1 O43174 1/20 0.43
ABCB11 O95342 1/20 0.43
ESR1 P03372 1/20 0.43
PGR P06401 1/20 0.43

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
SCHEMBL6679871 0.84 RXRA (0.59) RXRAHDAC3HDAC4HDAC1HDAC7
SCHEMBL31758293 0.77 RXRA (0.73) RXRAHDAC3HDAC4HDAC1HDAC7
SCHEMBL2594347 0.77 RXRA (0.73) RXRAHDAC3HDAC4HDAC1HDAC7
SCHEMBL24055389 0.73 RXRA (0.67) RXRAHDAC3HDAC4HDAC1HDAC7
SCHEMBL8199065 0.71 TDP1 (0.42) TDP1RXRAHDAC3HDAC4HDAC1
SCHEMBL6908235 0.70 RXRA (0.74) TDP1RXRAHDAC3HDAC4HDAC1
SCHEMBL6693435 0.69 RXRA (0.62) RXRARXRBRXRGMEN1CYP26A1
SCHEMBL6675847 0.69 RXRA (0.50) RXRARXRBRXRGMEN1CYP26A1
Ethylene SCHEMBL8070484 0.67 CA1 (0.73) TDP1MEN1KMT2ACA1CA2
SCHEMBL2655292 0.67 MEN1 (0.52) TDP1MEN1NR4A2KMT2ACA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004048390-A1 SILICON COMPOUNDS AMEDIS PHARMACEUTICALS LTD. (GB) 2004-06-10 WO disclosed
WO-2004048391-A1 SILICON COMPOUNDS TO BE USED AS LIGANDS FOR RETINOID RECEPTORS AMEDIS PHARMACEUTICALS LTD. (GB) 2004-06-10 WO disclosed