SCHEMBL12749048

SCHEMBL12749048

CCC(C)COC(=O)c1ccc(OC(=O)c2ccc(OCCC[Si](C)(C)O[SiH](C)C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.51
LMNA P02545 4/20 0.44
NPC1 O15118 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
KMT2A Q03164 4/20 0.43
NFKB1 P19838 3/20 0.43
NFKB2 Q00653 3/20 0.43
RELA Q04206 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
PRSS1 P07477 1/20 0.42
ACR P10323 1/20 0.42
TSHR P16473 2/20 0.40
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
MEN1 O00255 1/20 0.39

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
SCHEMBL12749046 0.97 MAPT (0.48) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL8925519 0.83 LMNA (0.48) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL9304783 0.81 LMNA (0.47) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL10613722 0.80 NPC1 (0.63) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL10611919 0.80 NPC1 (0.63) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL10610897 0.80 NPC1 (0.63) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL8990073 0.80 NPC1 (0.63) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL10613750 0.80 MAPT (0.57) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL11037678 0.80 NPC1 (0.63) MAPTLMNANPC1CYP1A2CYP2C9
SCHEMBL10721803 0.80 NPC1 (0.63) MAPTLMNANPC1CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7914485-B2 Medical device employing liquid crystal block copolymers and method of making the same BOSTON SCIENTIFIC SCIMED, INC. (US) 2011-03-29 US disclosed
US-20100016941-A1 MEDICAL DEVICE EMPLOYING LIQUID CRYSTAL BLOCK COPOLYMERS AND METHOD OF MAKING THE SAME BOSTON SCIENTIFIC SCIMED, INC. (US) 2010-01-21 US disclosed
US-7582078-B2 Medical device employing liquid crystal block copolymers and method of making the same BOSTON SCIENTIFIC SCIMED, INC. (US) 2009-09-01 US disclosed
US-20070191814-A1 Medical device employing liquid crystal block copolymers and method of making the same BOSTON SCIENTIFIC SCIMED, INC. (US) 2007-08-16 US disclosed