SCHEMBL20570255

SCHEMBL20570255

CC(C)(C)[Si](OCC12CC(C1)C2)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.41
CYP3A4 P08684 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM1A O60341 2/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31

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
SCHEMBL28388334 0.85 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL20253980 0.79 SMYD2 (0.37) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL16836641 0.79 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL22070547 0.79 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL6053638 0.79 SMN1; SMN2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2KDM1A
SCHEMBL6053645 0.79 SMN1; SMN2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2KDM1A
SCHEMBL2909392 0.79 SMN1; SMN2 (0.39) SMYD2CYP3A4HTTSMN1; SMN2KDM1A
SCHEMBL9470283 0.79 CYP3A4 (0.39) SMYD2CYP3A4HTTSMN1; SMN2KDM1A
SCHEMBL16837066 0.78 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL20569173 0.77 SMYD2 (0.34) SMYD2CYP3A4HTTSMN1; 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
WO-2018216822-A1 NOVEL IMIDAZOLE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2018-11-29 WO disclosed