SCHEMBL9315495

SCHEMBL9315495

C=Cc1cccc(OCCCC(C)(C)O[SiH3])c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 1/20 0.39
TLR2 O60603 1/20 0.39
FURIN P09958 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
TP53 P04637 1/20 0.37
PPARA Q07869 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
NPC1 O15118 5/20 0.34
RAB9A P51151 5/20 0.34
POLB P06746 4/20 0.34
CHRNA7 P36544 1/20 0.34
HPGD P15428 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
GGPS1 O95749 1/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL9315909 0.82 CHRNB2 (0.49) PPARASMN1; SMN2ALDH1A1CHRNA7HPGD
SCHEMBL6280406 0.81 TDP1 (0.42) TLR4TLR2FURINTDP1TP53
SCHEMBL9315822 0.80 TP53 (0.34) TDP1TP53
SCHEMBL25515931 0.78 TLR4 (0.40) TLR4TLR2FURINTDP1TP53
SCHEMBL8361886 0.78 TSHR (0.56) TP53ALDH1A1GGPS1
SCHEMBL412094 0.77 TLR4 (0.60) TLR4TLR2FURINTDP1TP53
SCHEMBL30988603 0.77 TDP1 (0.41) TLR4TLR2FURINTDP1TP53
SCHEMBL2623207 0.76 TSHR (0.57) TLR4TLR2KMT2AGGPS1
SCHEMBL10071523 0.76 FURIN (0.50) TLR4TLR2FURINTDP1TP53
SCHEMBL10071513 0.76 MAPK1 (0.49) TLR4TLR2FURINTDP1TP53

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