SCHEMBL7769306

SCHEMBL7769306

CC(c1ccccc1)[Si](Cl)(Cl)C(C)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
AOC3 Q16853 1/20 0.41
TAAR1 Q96RJ0 3/20 0.41
TRPA1 O75762 3/20 0.40
ADRA2A P08913 1/20 0.39
ADRA2C P18825 1/20 0.39
CYP2D6 P10635 1/20 0.39
LMNA P02545 1/20 0.39
HIF1A Q16665 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.38
DPP4 P27487 2/20 0.38
F2 P00734 1/20 0.38

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
SCHEMBL6671378 0.84 TSHR (0.43) TSHRAOC3TAAR1TRPA1ADRA2A
SCHEMBL208902 0.84 TSHR (0.43) TSHRAOC3TAAR1TRPA1ADRA2A
SCHEMBL7795647 0.84 TSHR (0.43) TSHRAOC3TAAR1TRPA1ADRA2A
SCHEMBL3799465 0.82 ADRA2A (0.43) TSHRAOC3TAAR1TRPA1ADRA2A
SCHEMBL7765413 0.78 TSHR (0.39) TSHRAOC3TAAR1TRPA1ADRA2A
Toluene SCHEMBL18394200 0.77 LMNA (0.48) TSHRAOC3TAAR1ADRA2AADRA2C
SCHEMBL11352850 0.77 AOC3 (0.41) TSHRAOC3TAAR1TRPA1LMNA
SCHEMBL6420857 0.76 TAAR1 (0.42) TSHRTAAR1TRPA1ADRA2AADRA2C
SCHEMBL25799302 0.76 TAAR1 (0.42) TSHRTAAR1TRPA1ADRA2AADRA2C
SCHEMBL22283420 0.74 ALDH1A1 (0.43) TAAR1TRPA1ADRA2AADRA2CCYP2D6

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-1110965-A2 Process for preparing 1,3-dihalo-1,1,3,3-tetra(organyl)disiloxanes Wacker-Chemie GmbH (DE) 2001-06-27 EP disclosed