SCHEMBL7106920

SCHEMBL7106920

CCCCC1=C([Si](C)(C)C2=C(CCCC)[CH]c3cccc(-c4ccc(CCCC)cc4)c32)c2c(cccc2-c2ccc(CCCC)cc2)[CH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.38
RAB9A P51151 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
TLR8 Q9NR97 1/20 0.35
BRS3 P32247 2/20 0.35
RARB P10826 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
NISCH Q9Y2I1 1/20 0.35
NFKB1 P19838 1/20 0.34

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
SCHEMBL7111531 0.96 KDM4E (0.40) HSD11B1RAB9ASMN1; SMN2TP53TSHR
SCHEMBL7108900 0.96 KDM4E (0.40) HSD11B1RAB9ASMN1; SMN2TP53TSHR
SCHEMBL7103912 0.96 HSD11B1 (0.37) HSD11B1RAB9ASMN1; SMN2NPC1TP53
SCHEMBL7109565 0.96 HSD11B1 (0.35) HSD11B1RAB9ASMN1; SMN2NPC1TP53
SCHEMBL7109432 0.95 KDM4E (0.41) HSD11B1RAB9ASMN1; SMN2TP53TSHR
SCHEMBL7105395 0.94 TLR8 (0.34) HSD11B1RAB9ASMN1; SMN2NPC1TP53
SCHEMBL7110767 0.91 KDM4E (0.38) HSD11B1RAB9ASMN1; SMN2TP53TSHR
SCHEMBL7108745 0.91 KDM4E (0.40) HSD11B1RAB9ASMN1; SMN2TP53TSHR
SCHEMBL7109744 0.91 SMN1; SMN2 (0.34) HSD11B1RAB9ASMN1; SMN2NPC1TSHR
SCHEMBL7111520 0.89 TLR8 (0.38) HSD11B1RAB9ASMN1; SMN2NPC1TSHR

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