SCHEMBL5488915

SCHEMBL5488915

Cc1cccc(CC[Si](Cl)(Cl)Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.57
MMP13 P45452 1/20 0.47
HRH3 Q9Y5N1 3/20 0.47
IDO1 P14902 2/20 0.46
CNR1 P21554 1/20 0.43
DAO P14920 2/20 0.42
ACHE P22303 1/20 0.42
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
NR3C2 P08235 1/20 0.41
GPR84 Q9NQS5 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40

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
Toluene SCHEMBL18394201 0.82 LMNA (0.46) TAAR1IDO1CNR1ACHE
SCHEMBL29596752 0.80 TAAR1 (0.74) TAAR1HRH3IDO1DAOACHE
SCHEMBL8096473 0.80 TAAR1 (0.74) TAAR1HRH3IDO1DAOACHE
SCHEMBL5486477 0.79 TAAR1 (0.50) TAAR1HRH3IDO1ACHECYP11B1
SCHEMBL28672310 0.78 TAAR1 (0.55) TAAR1MMP13HRH3IDO1CNR1
SCHEMBL5486678 0.78 TAAR1 (0.59) TAAR1IDO1
SCHEMBL4839367 0.78 TSHR (0.40) TAAR1
SCHEMBL25448924 0.77 TAAR1 (0.53) TAAR1MMP13HRH3IDO1CNR1
SCHEMBL13027403 0.77 TAAR1 (0.53) TAAR1MMP13HRH3IDO1DAO
SCHEMBL296315 0.77 TAAR1 (0.63) TAAR1HRH3IDO1DAOACHE

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
US-7291747-B2 Silicon compounds and process for preparation thereof CHISSO CORPORATION (JP) 2007-11-06 US disclosed
US-20040143081-A1 Novel silicon compounds and process for preparation thereof JNC CORPORATION (JP) 2004-07-22 US disclosed