SCHEMBL7523355

SCHEMBL7523355

CC[Si](CC)(CCc1cc(C(C)(C)C)c(OC(=O)CCC(=O)O)cc1C(C)(C)C)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 3/20 0.36
NPSR1 Q6W5P4 2/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
RBP4 P02753 3/20 0.33
ELANE P08246 1/20 0.33
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
S1PR1 P21453 2/20 0.30
AKR1C3 P42330 2/20 0.30
AKR1C2 P52895 2/20 0.30
AKR1C4 P17516 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
SCHEMBL7526616 0.80 VCAM1 (0.38) VCAM1NPSR1KDM4EMEN1RECQL
SCHEMBL7516417 0.73 VCAM1 (0.37) VCAM1NPSR1KDM4EMEN1RECQL
SCHEMBL27670207 0.70 TDP1 (0.55) VCAM1NPSR1KDM4EMEN1RECQL
SCHEMBL7517750 0.69 KDM4E (0.33) KDM4EPTGDR2
SCHEMBL7524936 0.68 VCAM1 (0.40) VCAM1NPSR1MEN1KMT2ARBP4
SCHEMBL18998964 0.67 VCAM1 (0.47) VCAM1NPSR1KDM4EMEN1KMT2A
SCHEMBL7516065 0.65 VCAM1 (0.39) VCAM1NPSR1KDM4EMEN1RECQL
SCHEMBL7515913 0.65 VCAM1 (0.43) VCAM1RBP4PTGDR2
SCHEMBL7525872 0.65 VCAM1 (0.36) VCAM1NPSR1KDM4ERBP4PTGDR2
SCHEMBL3551020 0.64 KDM4E (0.50) NPSR1KDM4EMEN1RECQLKMT2A

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