SCHEMBL5030652

SCHEMBL5030652

CC(C)C[Si](OCCc1ccco1)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.34
HSD17B10 Q99714 2/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPK1 P28482 1/20 0.32
LMNA P02545 1/20 0.32
KCNH3 Q9ULD8 1/20 0.31
HPGD P15428 3/20 0.31
TDP1 Q9NUW8 2/20 0.31
USP2 O75604 2/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
PLA2G1B P04054 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31
APEX1 P27695 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL5027934 0.74 SMYD2 (0.39) ALDH1A1HSD17B10KDM4EMEN1KMT2A
SCHEMBL4590746 0.73 HPGD (0.38) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL4590748 0.72 ALDH1A1 (0.35) ALDH1A1HSD17B10KDM4EPOLBMEN1
SCHEMBL4574556 0.72 HPGD (0.38) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL18270226 0.72 ALDH1A1 (0.35) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL9175019 0.69 LMNA (0.32) ALDH1A1LMNAHPGDTSHR
SCHEMBL25860125 0.69 ALDH1A1 (0.42) ALDH1A1HSD17B10KDM4EPOLBMEN1
SCHEMBL3180873 0.68 ALDH1A1 (0.40) ALDH1A1HSD17B10KDM4EPOLBMEN1
SCHEMBL7479973 0.67 LMNA (0.30) LMNA
SCHEMBL5028036 0.67 SMYD2 (0.38) ALDH1A1HSD17B10KDM4EMEN1KMT2A

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
WO-2008080986-A1 FURAN DERIVATIVES, METHOD OF SYNTHESIS AND USES THEREOF NEUROPHARMA, S.A. (ES) 2008-07-10 WO disclosed
EP-1939191-A1 Furan derivatives, method of synthesis and uses thereof Neuropharma S.A. (ES) 2008-07-02 EP disclosed