SCHEMBL5481190

SCHEMBL5481190

C[Si](C)(CCCC(N)=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
MGAM O43451 1/20 0.40
NR4A2 P43354 1/20 0.39
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HDAC5 Q9UQL6 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 2/20 0.37
TBXAS1 P24557 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
LTB4R Q15722 1/20 0.35
ATM Q13315 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
SCHEMBL11354893 0.87 MAPT (0.47) MAPTMGAMNR4A2HDAC3HDAC4
SCHEMBL9081726 0.84 MAPT (0.49) MAPTMGAMHDAC3HDAC4HDAC1
SCHEMBL11362605 0.81 HDAC3 (0.47) MAPTNR4A2HDAC3HDAC4HDAC1
SCHEMBL18084487 0.80 MGAM (0.44) MAPTMGAMHDAC3HDAC4HDAC1
SCHEMBL6912201 0.79 MAPT (0.55) MAPTNR4A2ALDH1A1LMNAKDM4E
SCHEMBL18227315 0.78 NR4A2 (0.35) MAPTNR4A2HDAC3HDAC4HDAC1
SCHEMBL9082981 0.78 TOP2A (0.52) ALDH1A1TBXAS1POLBCYP3A4CYP2C19
SCHEMBL9082507 0.78 MAPT (0.35) MAPTMGAM
SCHEMBL10607737 0.76 NR1H2 (0.56) MAPTMGAMNR1H2NR1H3POLB
SCHEMBL3865502 0.76 MGAM (0.40) MAPTMGAMNR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1737471-A2 PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE OF LIPOPHILIC, SILICON-SUBSTITUTED, CYCLOOXYGENASE-2 SELECTIVE NON-STEROIDAL ANTI-INFLAMMATORY DRUGS AND DERIVATIVES RND Pharmaceuticals (US) 2007-01-03 EP claimed
WO-2005102358-A2 SILICONE-SUBSTITUTED COX-2 SELECTIVE INHIBITORS RND PHARMACEUTICALS (US) 2005-11-03 WO claimed
CN-104641292-A PHOTOSENSITIVE RESIN COMPOSITION FOR DISPLAY DEVICE INSULATION FILM, AND DISPLAY DEVICE INSULATION FILM AND DISPLAY DEVICE USING SAME CHEIL IND INC 2015-05-20 CN disclosed
CN-101978322-B Positive photosensitive resin composition CHEIL IND INC 2014-11-05 CN disclosed
CN-101978322-A Positive photosensitive resin composition CHEIL IND INC 2011-02-16 CN disclosed