SCHEMBL8767889

SCHEMBL8767889

CCC(C(=O)O)[Si](C)(C)O[Si](C)(C)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
POLB P06746 3/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
NR4A2 P43354 1/20 0.33
PIN1 Q13526 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PPARG P37231 3/20 0.31
PPARA Q07869 3/20 0.31
NPC1 O15118 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
SCHEMBL2783708 0.78 CA2 (0.32)
SCHEMBL7894378 0.78 MAPT (0.40) MAPTPOLBLMNAHSD17B10ESR1
SCHEMBL1882370 0.72 ALDH1A1 (0.39) MAPTLMNAALDH1A1HSD17B10ESR1
SCHEMBL16862414 0.72 ALDH1A1 (0.42) MAPTLMNAALDH1A1PPARG
SCHEMBL121414 0.70 ESR1 (0.42) MAPTPOLBLMNAALDH1A1ESR1
SCHEMBL435743 0.68 MAPT (0.36) MAPTLMNAESR1ESR2NPSR1
SCHEMBL13621393 0.67 ESR1 (0.34) MAPTALDH1A1ESR1ESR2NPC1
SCHEMBL11809786 0.67 LMNA (0.41) MAPTPOLBLMNAALDH1A1ESR1
SCHEMBL11131500 0.67 KMT2A (0.46) MAPTPOLBLMNAALDH1A1L3MBTL1
SCHEMBL16603060 0.67 ESR1 (0.41) MAPTESR1ESR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640221-B1 SURFACE WETTABLE SILICONE HYDROGELS BAUSCH & LOMB (US) 1997-07-16 EP claimed
EP-0611367-B1 NOVEL UV CURABLE CROSSLINKING AGENTS USEFUL IN COPOLYMERIZATION BAUSCH & LOMB (US) 1997-06-25 EP claimed
EP-0603268-B1 WETTABLE SILICONE HYDROGEL COMPOSITIONS AND METHODS BAUSCH & LOMB (US) 1996-12-18 EP claimed
EP-0611380-B1 WETTABLE SILICONE HYDROGEL COMPOSITIONS AND METHODS FOR THEIR MANUFACTURE BAUSCH & LOMB (US) 1996-06-19 EP claimed