SCHEMBL6955161

SCHEMBL6955161

COC(=O)c1ccc(CNc2ccc(O[Si](C)(C)C(C)(C)C)cc2N)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.39
HDAC1 Q13547 1/20 0.37
DRD2 P14416 1/20 0.37
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ASPH Q12797 1/20 0.36
RIOX2 Q8IUF8 1/20 0.36
KDM8 Q8N371 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CD38 P28907 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL6954518 0.85 ABCB1 (0.44) GAAALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL16857041 0.78 ALDH1A1 (0.53) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL6953338 0.75 KDM4E (0.42) HDAC1KDM4ELMNASMN1; SMN2
SCHEMBL6519025 0.73 KDM4E (0.50) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL7627705 0.73 MAPT (0.44) GAADRD2KDM4EALDH1A1MAPT
SCHEMBL12099986 0.73 KDM4E (0.48) GAAHDAC1KDM4EALDH1A1MAPT
SCHEMBL8128802 0.73 KDM4E (0.44) GAADRD2KDM4EALDH1A1MAPT
SCHEMBL2320471 0.71 DRD2 (0.46) GAADRD2KDM4EALDH1A1MAPT
SCHEMBL20046200 0.70 CA1 (0.43) GAAKDM4EALDH1A1MAPTHPGD
SCHEMBL5226494 0.69 HDAC1 (0.57) GAAHDAC1KDM4EALDH1A1MAPT

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-1019047-B1 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2003-11-05 EP disclosed
US-6541499-B1 Antithrombotic agents ELI LILLY AND COMPANY 2003-04-01 US disclosed
EP-1019047-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2001-06-13 EP disclosed
EP-1019047-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-19 EP disclosed
WO-1998048800-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 WO disclosed