SCHEMBL4707744

SCHEMBL4707744

Cc1ccc([SiH](O[PH](=O)O[SiH](c2ccc(C)cc2)c2ccc(C)cc2)c2ccc(C)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 3/20 0.36
ACHE P22303 2/20 0.36
LMNA P02545 2/20 0.35
SRD5A2 P31213 1/20 0.35
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
CYP2A6 P11509 1/20 0.31
GAA P10253 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL3299815 0.72 ACHE (0.47) ALDH1A1SMN1; SMN2TDP1ACHELMNA
SCHEMBL8155100 0.70 ACHE (0.44) ALDH1A1SMN1; SMN2TDP1ACHELMNA
SCHEMBL9284526 0.69 ACHE (0.42) ALDH1A1SMN1; SMN2TDP1ACHELMNA
SCHEMBL3871927 0.67 ACHE (0.40) ALDH1A1SMN1; SMN2TDP1ACHELMNA
SCHEMBL4707286 0.67 RAPGEF4 (0.31)
SCHEMBL3873998 0.65 ACHE (0.38) ALDH1A1SMN1; SMN2TDP1ACHELMNA
SCHEMBL3875561 0.65 ACHE (0.38) ALDH1A1SMN1; SMN2TDP1ACHELMNA
SCHEMBL3867520 0.65 ACHE (0.38) ALDH1A1SMN1; SMN2TDP1ACHELMNA
P-Xylene SCHEMBL28865890 0.64 ACHE (0.73) ALDH1A1SMN1; SMN2TDP1ACHELMNA
SCHEMBL1416559 0.64 ACHE (0.48) ALDH1A1SMN1; SMN2TDP1ACHELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1368384-B1 MANUFACTURE OF CONJUGATED DIENE POLYMERS USING AN IRON-BASED CATALYST COMPOSITION BRIDGESTONE CORP (JP) 2008-08-20 EP disclosed
EP-1368384-A1 MANUFACTURE OF CONJUGATED DIENE POLYMERS USING AN IRON-BASED CATALYST COMPOSITION Bridgestone Corporation (JP) 2003-12-10 EP disclosed
US-6627712-B2 Reaction product of an iron-containing compound, a silyl phosphonate, and an organoaluminum compound to polymerize 1,3-butadiene into syndiotactic 1,2-polybutadiene BRIDGESTONE CORPORATION (JP) 2003-09-30 US disclosed
US-6545107-B2 Reaction product of an molybdenum- containing compound, a silyl phosphonate; and an organoaluminum compound catalyst used for polymerizing conjugated diene monomer BRIDGESTONE CORPORATION (JP) 2003-04-08 US disclosed
WO-2002100910-A1 MOLYBDENUM-BASED CATALYST COMPOSITION FOR PRODUCING SYNDIOTACTIC 1,2-POLYBUTADIENE BRIDGESTONE CORPORATION (JP) 2002-12-19 WO disclosed
US-20020156210-A1 Manufacture of conjugated diene polymers by using an iron-based catalyst composition BRIDGESTONE CORP. 2002-10-24 US disclosed
WO-2002081082-A1 IRON-BASED CATALYST COMPOSITION FOR PRODUCING OLIGOMERS OF CONJUGATED DIENES BRIDGESTONE CORPORATION (JP) 2002-10-17 WO disclosed
WO-2002066525-A1 CHROMIUM-BASED CATALYST COMPOSITION BRIDGESTONE CORPORATION (JP) 2002-08-29 WO disclosed
WO-2002066523-A1 MANUFACTURE OF CONJUGATED DIENE POLYMERS USING AN IRON-BASED CATALYST COMPOSITION BRIDGESTONE CORPORATION (JP) 2002-08-29 WO disclosed
US-20020115558-A1 CHROMIUM-BASED CATALYST COMPOSITION FOR PRODUCING CONJUGATED DIENE POLYMERS BRIDGESTONE CORP. 2002-08-22 US disclosed
US-6433237-B1 USING COORDINATION CATALYST BRIDGESTONE CORPORATION (JP) 2002-08-13 US disclosed