SCHEMBL8109516

SCHEMBL8109516

CCC(C)COc1cccc([SiH2]C)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 1/20 0.48
FFAR1 O14842 1/20 0.40
MCHR1 Q99705 1/20 0.40
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
TLR8 Q9NR97 1/20 0.38
GRM2 Q14416 1/20 0.37
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HIF1A Q16665 1/20 0.36
LMNA P02545 1/20 0.36
SCN4A P35499 2/20 0.36
GPR88 Q9GZN0 1/20 0.36
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 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
SCHEMBL17138170 0.84 GPBAR1 (0.60) GPBAR1FFAR1MCHR1ADRB2ADRB1
SCHEMBL10154613 0.80 ADRB2 (0.56) GPBAR1ADRB2ADRB1LMNA
SCHEMBL1581657 0.77 GPBAR1 (0.53) GPBAR1FFAR1ADRB2ADRB1TSHR
SCHEMBL11162901 0.77 GPBAR1 (0.50) GPBAR1FFAR1ADRB2ADRB1GRM2
SCHEMBL4970580 0.77 MAOB (0.50) GPBAR1FFAR1LMNA
SCHEMBL19122314 0.77 KDM4E (0.56) GPBAR1FFAR1TSHRLMNAGPR88
SCHEMBL2500159 0.75 FFAR1 (0.61) GPBAR1FFAR1ADRB2ADRB1TLR8
SCHEMBL28294103 0.75 FFAR1 (0.61) GPBAR1FFAR1ADRB2ADRB1TLR8
SCHEMBL19291755 0.74 GPBAR1 (0.48) GPBAR1FFAR1GRM2HIF1A
SCHEMBL12094232 0.74 GPBAR1 (0.48) GPBAR1FFAR1MCHR1TLR8TSHR

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
JP-2000169589-A OPTICALLY ACTIVE ORGANOSILICON HOMOPOLYMER AND COPOLYMER NIPPON TELEGR & TELEPH CORP <NTT> 2000-06-20 JP disclosed