SCHEMBL25909655

SCHEMBL25909655

C[C@@H](c1ccccc1)[Si](F)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.38
TAAR1 Q96RJ0 5/20 0.37
ADRA2A P08913 1/20 0.35
ADRA2C P18825 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
CYP2D6 P10635 1/20 0.35
LMNA P02545 1/20 0.35
HIF1A Q16665 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TRPA1 O75762 1/20 0.34
ALOX5 P09917 1/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL705454 0.78 TDP1 (0.39) AOC3TAAR1ESR1ESR2LMNA
SCHEMBL19309372 0.74 ESR1 (0.41) TAAR1ADRA2AADRA2CESR1ESR2
SCHEMBL6420857 0.70 TAAR1 (0.42) TAAR1ADRA2AADRA2CCYP2D6LMNA
SCHEMBL7769306 0.69 TSHR (0.43) AOC3TAAR1ADRA2AADRA2CCYP2D6
SCHEMBL22283420 0.69 ALDH1A1 (0.43) TAAR1ADRA2AADRA2CCYP2D6LMNA
SCHEMBL6671378 0.69 TSHR (0.43) AOC3TAAR1ADRA2AADRA2CCYP2D6
SCHEMBL711378 0.69 ESR1 (0.34) AOC3TAAR1ADRA2AADRA2CESR1
SCHEMBL7795647 0.69 TSHR (0.43) AOC3TAAR1ADRA2AADRA2CCYP2D6
SCHEMBL708624 0.69 CYP2D6 (0.34) AOC3TAAR1ESR1ESR2CYP2D6
SCHEMBL208902 0.69 TSHR (0.43) AOC3TAAR1ADRA2AADRA2CCYP2D6

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-20230241597-A1 PLATFORM FOR THE RECOVERY OF TRANSITION METAL CATALYSTS TEXAS TECH UNIVERSITY SYSTEM 2023-08-03 US disclosed