SCHEMBL7195124

SCHEMBL7195124

CC(=O)CCCCO[Si](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DUT P33316 1/20 0.44
ALDH1A1 P00352 1/20 0.42
PPARA Q07869 3/20 0.38
TBXA2R P21731 1/20 0.37
HDAC1 Q13547 8/20 0.37
HDAC2 Q92769 8/20 0.37
TDP1 Q9NUW8 1/20 0.37
HDAC3 O15379 6/20 0.36
HDAC4 P56524 6/20 0.36
HDAC7 Q8WUI4 6/20 0.36
HDAC10 Q969S8 6/20 0.36
HDAC11 Q96DB2 6/20 0.36
HDAC8 Q9BY41 6/20 0.36
HDAC6 Q9UBN7 6/20 0.36
HDAC9 Q9UKV0 6/20 0.36
HDAC5 Q9UQL6 6/20 0.36
MAPT P10636 1/20 0.36
TBXAS1 P24557 1/20 0.35

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
SCHEMBL7191495 0.98 DUT (0.43) DUTALDH1A1PPARATBXA2RHDAC1
SCHEMBL7194972 0.95 DUT (0.46) DUTALDH1A1TDP1MAPT
SCHEMBL7185042 0.84 DUT (0.43) DUTALDH1A1PPARAHDAC1HDAC2
SCHEMBL17755998 0.81 SMYD2 (0.42) ALDH1A1PPARAHDAC1HDAC2TDP1
SCHEMBL5000451 0.81 DUT (0.43) DUTPPARATBXA2RHDAC1HDAC2
SCHEMBL7188133 0.79 DUT (0.43) DUTALDH1A1TDP1MAPT
SCHEMBL7190570 0.78 DUT (0.46) DUTALDH1A1HDAC1HDAC2TDP1
SCHEMBL7190329 0.78 DUT (0.43) DUTALDH1A1TDP1MAPT
SCHEMBL7190720 0.77 DUT (0.43) DUTALDH1A1TDP1MAPT
SCHEMBL12921004 0.76 SMYD2 (0.42) ALDH1A1PPARAMAPT

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
US-6534665-B1 Used for polymerization and copolymerization of olefins REPSOL QUIMICA S.A. (ES) 2003-03-18 US claimed
US-6534665-B1 Used for polymerization and copolymerization of olefins REPSOL QUIMICA S.A. (ES) 2003-03-18 US disclosed