SCHEMBL11116563

SCHEMBL11116563

CC(C)(C)c1ccc(CC[Si](Cl)(CCc2ccc(C(C)(C)C)cc2)O[Si](C)(C)Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.40
ESRRG P62508 5/20 0.38
SIGMAR1 Q99720 4/20 0.38
ESRRB O95718 2/20 0.37
CNR1 P21554 1/20 0.37
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
ADRA1D P25100 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
GRIA4 P48058 1/20 0.36
EPHX2 P34913 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
APP P05067 1/20 0.35
LMNA P02545 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
SCHEMBL2869439 0.80 KCNH2 (0.46) KCNH2ESRRGSIGMAR1ESRRBCNR1
SCHEMBL1275239 0.78 KCNH2 (0.47) KCNH2ESRRGSIGMAR1ESRRBCNR1
SCHEMBL11120539 0.78 KCNH2 (0.47) KCNH2ESRRGSIGMAR1ESRRBCNR1
SCHEMBL11115201 0.76 KCNH2 (0.42) KCNH2ESRRGSIGMAR1ESRRBADRA2A
SCHEMBL19019721 0.76 KCNH2 (0.42) KCNH2ESRRGSIGMAR1ESRRBADRA2A
SCHEMBL30064836 0.72 ESRRG (0.45) KCNH2ESRRGSIGMAR1ESRRBCNR1
SCHEMBL7456580 0.71 KCNH2 (0.59) KCNH2ESRRGSIGMAR1ESRRBBCHE
SCHEMBL28660351 0.69 KCNH2 (0.46) KCNH2ESRRGSIGMAR1ESRRBGRIA4
SCHEMBL8955876 0.68 KCNH2 (0.52) KCNH2ESRRGSIGMAR1ESRRBCNR1
SCHEMBL697688 0.68 CA2 (0.52) KCNH2ESRRGSIGMAR1ESRRBGRIA4

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
US-4469881-A [2-(p-t-Butylphenyl)ethyl]silanes and method of making the same PETRARCH SYSTEMS INC. (US) 1984-09-04 US disclosed