SCHEMBL7517862

SCHEMBL7517862

CCc1cc(CC[Si](C)(C)c2ccc(N(C)C)cc2)cc(CC)c1OC(C)=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.34
MAPT P10636 7/20 0.33
CALM1 P0DP23 2/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
PSMB5 P28074 1/20 0.31
MAPK1 P28482 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL7522609 0.84 CALM1 (0.33) MAPTCALM1ALDH1A1HPGDMEN1
SCHEMBL7517843 0.82 CALM1 (0.36) MAPTCALM1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL27566673 0.75 KMT2A (0.37) AKT1MAPTALDH1A1KDM4ESMN1; SMN2
SCHEMBL7521009 0.73 VCAM1 (0.37) CALM1KMT2AGAA
SCHEMBL7517609 0.70 VCAM1 (0.45) MAPTCALM1ALDH1A1SMN1; SMN2MAPK1
SCHEMBL27852474 0.69 AKT1 (0.46) AKT1MAPTALDH1A1KDM4ESMN1; SMN2
SCHEMBL7523700 0.69 NR1H4 (0.35) MEN1KMT2AGAA
SCHEMBL7526592 0.68 MEN1 (0.32) MAPTALDH1A1HPGDCYP2C19MEN1
SCHEMBL7516554 0.68 GAA (0.34) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL7506473 0.65 AKT1 (0.47) AKT1MAPTALDH1A1HPGDKDM4E

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
EP-0900225-B1 ALKYL-4-SILYL-PHENOLS AND ESTERS THEREOF AS ANTIATHEROSCLEROTIC AGENTS AVENTIS PHARMA INC (US) 2002-01-30 EP disclosed
US-5608095-A Alkyl-4-silyl-phenols and esters thereof as antiatherosclerotic agents HOECHST MARION ROUSSEL, INC. (US) 1997-03-04 US disclosed