SCHEMBL7181669

SCHEMBL7181669

CO[Si](OC)(OC)c1ccccc1C#CC#Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.37
NPC1 O15118 5/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
HPGD P15428 2/20 0.35
CYP2C19 P33261 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 2/20 0.35
HSD17B10 Q99714 1/20 0.35
GRM5 P41594 7/20 0.32
KCNH2 Q12809 2/20 0.32
PDGFRB P09619 1/20 0.32
PDGFRA P16234 1/20 0.32
RAB9A P51151 4/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL7183857 0.89 NPC1 (0.46) APPNPC1SMN1; SMN2KDM4EMEN1
SCHEMBL6437480 0.77 NPC1 (0.41) APPNPC1SMN1; SMN2KDM4EMEN1
SCHEMBL7191185 0.74 NPC1 (0.44) APPNPC1SMN1; SMN2KDM4EMEN1
Benzene SCHEMBL28228276 0.72 CA4 (0.41) SMN1; SMN2KDM4EMEN1ALDH1A1CYP1A2
SCHEMBL6036840 0.72 TSHR (0.45) NPC1SMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL332012 0.70 ALDH1A1 (0.41) NPC1SMN1; SMN2KDM4EMEN1ALDH1A1
SCHEMBL30264142 0.70 ALDH1A1 (0.41) NPC1SMN1; SMN2KDM4EMEN1ALDH1A1
SCHEMBL17312253 0.69 APP (0.73) APPNPC1SMN1; SMN2KDM4EMEN1
Benzene SCHEMBL28733255 0.69 APP (0.73) APPNPC1SMN1; SMN2KDM4EMEN1
SCHEMBL30495998 0.69 APP (0.73) APPNPC1SMN1; SMN2KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1276807-A1 CURABLE SILICONE RESIN COMPOSITION AND REACTIVE SILICON COMPOUNDS Dow Corning Corporation (US) 2003-01-22 EP disclosed
WO-2001083608-A1 CURABLE SILICONE RESIN COMPOSITION AND REACTIVE SILICON COMPOUNDS DOW CORNING CORPORATION (US) 2001-11-08 WO disclosed