SCHEMBL4643590

SCHEMBL4643590

[CH2]CC(=O)O[Si](c1ccc(C)cc1)(c1ccc(C)cc1)c1ccc(C)cc1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 5/20 0.34
LMNA P02545 3/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
TDP1 Q9NUW8 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
GSK3B P49841 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL4645473 0.86 L3MBTL1 (0.35) CYP2C19ALDH1A1LMNACES2CES1
SCHEMBL4643859 0.83 CYP2C19 (0.36) CYP2C19ALDH1A1LMNACES2CES1
SCHEMBL4645869 0.83 KMT2A (0.35) CYP2C19LMNATDP1MAPTL3MBTL1
SCHEMBL4647347 0.81 ALDH1A1 (0.36) CYP2C19ALDH1A1LMNACES2CES1
SCHEMBL4644249 0.81 ALDH1A1 (0.33) ALDH1A1LMNACES2CES1TDP1
SCHEMBL4644558 0.80 L3MBTL1 (0.36) CYP2C19ALDH1A1LMNACES2CES1
SCHEMBL4642549 0.79 L3MBTL1 (0.35) CYP2C19ALDH1A1LMNACES2CES1
SCHEMBL4642082 0.77 L3MBTL1 (0.34) CYP2C19LMNATDP1MAPTL3MBTL1
SCHEMBL475824 0.76 LMNA (0.48) ALDH1A1LMNACES2CES1TDP1
SCHEMBL4644326 0.76 L3MBTL1 (0.37) CYP2C19ALDH1A1LMNATDP1SMN1; 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
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed