SCHEMBL7554485

SCHEMBL7554485

CC(C)(C)[Si](C)(C)Oc1ccc(-c2cccnc2C(O)c2ncccc2-c2ccc(O[Si](C)(C)C(C)(C)C)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PREP P48147 4/20 0.39
FFAR4 Q5NUL3 2/20 0.34
CA12 O43570 4/20 0.33
CA1 P00915 4/20 0.33
CA9 Q16790 4/20 0.33
ADRB2 P07550 2/20 0.33
ADRB1 P08588 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
SYK P43405 1/20 0.31
AURKB Q96GD4 1/20 0.31
INCENP Q9NQS7 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL623032 0.79 MKNK1 (0.47) PREPCA12CA1CA9MKNK1
SCHEMBL7556356 0.74 ALDH1A1 (0.41) ALDH1A1HPGDLMNAMAPT
SCHEMBL15105024 0.73 MKNK1 (0.39) PREPKDM4EMKNK1MKNK2SYK
SCHEMBL16171288 0.72 PREP (0.51) PREPCA12CA1CA9KDM4E
SCHEMBL23491348 0.72 PREP (0.57) PREPCA12CA1CA9KDM4E
SCHEMBL7552809 0.71 TDP1 (0.43) KDM4EALDH1A1HPGDLMNAMAPT
SCHEMBL7558423 0.71 KDM4E (0.44) KDM4EALDH1A1HPGDMAPTCLK4
SCHEMBL6763899 0.70 PREP (0.53) PREPCA12CA1CA9KDM4E
SCHEMBL30629151 0.69 PREP (0.41) PREPCA12CA1CA9
SCHEMBL9958908 0.69 CCR1 (0.42) PREPCA12CA1CA9KDM4E

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
EP-1036081-B1 HETEROCYCLYL LIGAND CONTAINING RUTHENIUM AND OSMIUM CATALYSTS CIBA SC HOLDING AG (CH) 2002-07-17 EP disclosed
US-6417363-B1 POLYMERIZATION, RING-CLOSURE METATHESIS, OLIGOMERIZATION, AND CYCLIZATION CATALYSTS CIBA SPECIALTY CHEMICALS CORPORATION 2002-07-09 US disclosed
EP-1036081-A1 HETEROCYCLYL LIGAND CONTAINING RUTHENIUM AND OSMIUM CATALYSTS Ciba SC Holding AG (CH) 2000-09-20 EP disclosed
WO-1999029701-A1 HETEROCYCLYL LIGAND CONTAINING RUTHENIUM AND OSMIUM CATALYSTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1999-06-17 WO disclosed