SCHEMBL7109434

SCHEMBL7109434

CCCCCCC1=Cc2c(-c3ccc(CCCCCC)cc3)cccc2C1C[SiH2]CC1C(CCCCCC)=Cc2c(-c3ccc(CCCCCC)cc3)cccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.37
SLC6A4 P31645 3/20 0.37
HSD11B1 P28845 3/20 0.37
HTR2A P28223 2/20 0.37
HTR2C P28335 2/20 0.37
DRD2 P14416 1/20 0.37
HSD17B10 Q99714 3/20 0.36
TSHR P16473 1/20 0.36
RARB P10826 7/20 0.36
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
RARA P10276 1/20 0.36
MTOR P42345 1/20 0.36
ESR1 P03372 2/20 0.35
ADRA2A P08913 2/20 0.35
ADORA3 P0DMS8 2/20 0.35
TACR2 P21452 2/20 0.35
SLC6A3 Q01959 2/20 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
SCHEMBL7111534 0.99 SLC6A2 (0.37) SLC6A2SLC6A4HSD11B1HTR2AHTR2C
SCHEMBL7108905 0.99 SLC6A2 (0.37) SLC6A2SLC6A4HSD11B1HTR2AHTR2C
SCHEMBL7108748 0.97 SLC6A2 (0.37) SLC6A2SLC6A4HSD11B1HTR2AHTR2C
SCHEMBL7110770 0.97 HSD11B1 (0.34) SLC6A2SLC6A4HSD11B1HTR2AHTR2C
SCHEMBL7106922 0.95 HSD11B1 (0.34) SLC6A2SLC6A4HSD11B1HTR2AHTR2C
SCHEMBL7111659 0.94 DRD2 (0.34) SLC6A2SLC6A4HSD11B1HTR2AHTR2C
SCHEMBL7103915 0.92 HSD11B1 (0.33) SLC6A2SLC6A4HSD11B1HTR2AHTR2C
SCHEMBL7109568 0.92 TLR8 (0.31) HSD11B1RARBTLR8
SCHEMBL7109462 0.91 GCGR (0.31) SLC6A2SLC6A4HSD11B1HTR2AHTR2C
SCHEMBL7105397 0.89 EDNRB (0.32) TLR8

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