SCHEMBL7107950

SCHEMBL7107950

CCCCCCC1=C([Si](C)(C)C2=C(CCCCCC)[CH]c3cccc(-c4ccc(C(C)(C)C)cc4)c32)c2c(cccc2-c2ccc(C(C)(C)C)cc2)[CH]1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CNR1 P21554 4/20 0.33
CNR2 P34972 4/20 0.33
S1PR1 P21453 1/20 0.33
TLR8 Q9NR97 1/20 0.32
DHFR P00374 1/20 0.32
KCNH2 Q12809 1/20 0.32
PTAFR P25105 1/20 0.32
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
DGAT1 O75907 2/20 0.30
GHSR Q92847 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
SCHEMBL7105422 0.95 NPC1 (0.35) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL7111654 0.91 NPC1 (0.36) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL7109460 0.88 GCGR (0.38) NPC1RAB9ASMN1; SMN2TLR8DHFR
SCHEMBL7109432 0.87 KDM4E (0.41) RAB9ALMNATP53SMN1; SMN2TLR8
SCHEMBL7111520 0.86 TLR8 (0.38) NPC1RAB9ASMN1; SMN2TLR8DHFR
SCHEMBL7111531 0.86 KDM4E (0.40) RAB9ALMNATP53SMN1; SMN2TLR8
SCHEMBL7108900 0.86 KDM4E (0.40) RAB9ALMNATP53SMN1; SMN2TLR8
SCHEMBL7110767 0.86 KDM4E (0.38) RAB9ALMNATP53SMN1; SMN2TLR8
SCHEMBL7106420 0.86 NPC1 (0.38) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL7111529 0.84 GCGR (0.35) TLR8DHFRKCNH2

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
EP-1053263-B1 CATALYST SYSTEM BASELL POLYOLEFINE GMBH (DE) 2003-10-01 EP claimed