SCHEMBL9157653

SCHEMBL9157653

CC[Si](C)(C)CCCCc1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.41
NFKB1 P19838 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HMOX1 P09601 1/20 0.41
TAAR1 Q96RJ0 3/20 0.41
HTR2A P28223 2/20 0.41
POLB P06746 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
HSP90AA1 P07900 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
ESR1 P03372 2/20 0.36
ADRA2A P08913 2/20 0.36
ADORA3 P0DMS8 2/20 0.36
TACR2 P21452 2/20 0.36
SLC6A2 P23975 2/20 0.36

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
SCHEMBL9155362 0.77 TSHR (0.57) HSD17B10
SCHEMBL7904900 0.77 TAAR1 (0.62) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL9153598 0.76 RARB (0.59) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL1815390 0.76 ESR1 (0.59) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL31335119 0.75 HMOX1 (0.40) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL31335193 0.75 HMOX1 (0.40) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL15583726 0.75 TAAR1 (0.59) HMOX1TAAR1HTR2AHSP90AA1SIGMAR1
SCHEMBL134452 0.75 TAAR1 (0.59) HMOX1TAAR1HTR2AHSP90AA1SIGMAR1
SCHEMBL14838178 0.75 CHRM2 (0.47) L3MBTL1HTR2ASIGMAR1ADRA2ASLC6A2
SCHEMBL5490192 0.75 TAAR1 (0.45) NPC1NFKB1MAPK1RAB9ANFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0424959-B1 Organosilylalkyl-aromatic compounds CONSORTIUM ELEKTROCHEM IND (DE) 1995-02-01 EP disclosed
US-5210247-A ORGANOSILYLALKYLAROMATIC COMPOUNDS CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1993-05-11 US disclosed