SCHEMBL9315472

SCHEMBL9315472

C=Cc1cccc(OCCC[Si](Cl)(Cl)Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FURIN P09958 1/20 0.41
TLR4 O00206 1/20 0.40
TLR2 O60603 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPK1 P28482 1/20 0.39
PRSS1 P07477 8/20 0.37
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HPGD P15428 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 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
SCHEMBL9315952 0.88 TLR4 (0.41) FURINTLR4TLR2NPC1RAB9A
SCHEMBL9315802 0.88 TLR4 (0.41) FURINTLR4TLR2NPC1RAB9A
SCHEMBL14369375 0.84 TLR4 (0.43) FURINTLR4TLR2NPC1RAB9A
SCHEMBL14369378 0.82 TLR4 (0.44) FURINTLR4TLR2NPC1RAB9A
SCHEMBL9315977 0.82 NPC1 (0.43) FURINTLR4TLR2NPC1RAB9A
SCHEMBL9315501 0.81 TLR4 (0.40) FURINTLR4TLR2NPC1RAB9A
SCHEMBL8776506 0.81 TLR4 (0.40) FURINTLR4TLR2NPC1RAB9A
SCHEMBL9315995 0.80 CHRNA7 (0.50) SMN1; SMN2PRSS1TP53HPGDMEN1
SCHEMBL16956899 0.80 FURIN (0.42) FURINTLR4TLR2NPC1RAB9A
SCHEMBL3566872 0.80 KCNA3 (0.57) FURINTLR4TLR2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5342983-A Polymer reforming agents SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-08-30 US disclosed