SCHEMBL9008955

SCHEMBL9008955

CC(C)(C)[Si](OCc1cccc(-c2ccccc2)n1)(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPV3 Q8NET8 5/20 0.43
MEN1 O00255 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
PDE10A Q9Y233 2/20 0.38
ASIC3 Q9UHC3 1/20 0.38
KCNH2 Q12809 1/20 0.37
HCRTR1 O43613 4/20 0.35
HCRTR2 O43614 4/20 0.35
HTR1A P08908 1/20 0.35
DRD2 P14416 1/20 0.35
HTR2A P28223 1/20 0.35
HTR7 P34969 1/20 0.35
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
SHMT1 P34896 1/20 0.34
CYP3A4 P08684 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL9008915 0.91 SCN9A (0.39) TRPV3MEN1RAB9AKMT2AHCRTR1
SCHEMBL9174404 0.82 SMN1; SMN2 (0.42) MEN1RAB9AKMT2AKCNH2SMN1; SMN2
SCHEMBL8777276 0.81 KCNH2 (0.41) TRPV3KCNH2CYP3A4HTTSMN1; SMN2
SCHEMBL4134240 0.81 KCNH2 (0.38) KCNH2HTR7CYP3A4HTTSMN1; SMN2
SCHEMBL4136544 0.79 GRM5 (0.38) PDE10AKCNH2HTR1ADRD2HTR2A
SCHEMBL7467379 0.77 MRGPRX4 (0.49)
SCHEMBL8777267 0.77 KCNH2 (0.35) KCNH2CYP3A4HTTSMN1; SMN2
SCHEMBL13831044 0.76 MEN1 (0.54) TRPV3MEN1RAB9AKMT2APDE10A
SCHEMBL2225215 0.74 POLB (0.38) MEN1KMT2A
SCHEMBL8977847 0.74 MRGPRX4 (0.47) RAB9ACYP3A4SMN1; SMN2

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-5576338-A ANTIALLERGENS, ANTIHISTAMINES, ANTIINFLAMMATORY AGENTS AND CYTOPROTECTIVE AGENTS FOR CARDIOVASCULAR DISORDERS MERCK FROSST CANADA, INC. (CA) 1996-11-19 US disclosed