SCHEMBL449386

SCHEMBL449386

CCCCCCC(N)[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.41
SPHK1 Q9NYA1 2/20 0.39
CYP2D6 P10635 2/20 0.37
LMNA P02545 2/20 0.37
TP53 P04637 2/20 0.37
LAP3 P28838 2/20 0.37
PLA2G1B P04054 1/20 0.37
PLA2G2A P14555 1/20 0.37
GMNN O75496 1/20 0.37
POLB P06746 1/20 0.37
THPO P40225 1/20 0.37
MTOR P42345 1/20 0.37
BLM P54132 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
CETP P11597 1/20 0.37
HTT P42858 1/20 0.37
UBE2N P61088 1/20 0.37

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
SCHEMBL446508 0.98 OPRM1 (0.43) OPRM1SPHK1CYP2D6LMNATP53
SCHEMBL446942 0.92 OPRM1 (0.34) OPRM1
SCHEMBL449037 0.83
SCHEMBL10753426 0.81
SCHEMBL12804734 0.79 OPRM1 (0.44) OPRM1SPHK1CYP2D6LMNATP53
SCHEMBL1568831 0.79 OPRM1 (0.44) OPRM1SPHK1CYP2D6LMNATP53
SCHEMBL2499317 0.79 OPRM1 (0.44) OPRM1SPHK1CYP2D6LMNATP53
SCHEMBL2991866 0.79 OPRM1 (0.44) OPRM1SPHK1CYP2D6LMNATP53
SCHEMBL2993823 0.78 OPRM1 (0.48) OPRM1SPHK1CYP2D6LMNATP53
SCHEMBL456778 0.78 OPRM1 (0.48) OPRM1SPHK1CYP2D6LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2307190-B1 SILICONE-CONTAINING POLYMERIC MATERALS WITH HYDROLYZABLE GROUPS NOVARTIS AG (CH) 2015-03-18 EP disclosed
US-8883928-B2 Silicone-containing polymeric materials with hydrolyzable groups NOVARTIS AG (CH) 2014-11-11 US disclosed
US-20120065331-A1 SILICONE-CONTAINING POLYMERIC MATERIALS WITH HYDROLYZABLE GROUPS ALCON INC. (CH) 2012-03-15 US disclosed
US-8079703-B2 Silicone-containing polymeric materials with hydrolyzable groups NOVARTIS AG (CH) 2011-12-20 US disclosed
EP-2307190-A1 SILICONE-CONTAINING POLYMERIC MATERALS WITH HYDROLYZABLE GROUPS Novartis AG (CH) 2011-04-13 EP disclosed
WO-2010011493-A1 SILICONE-CONTAINING POLYMERIC MATERALS WITH HYDROLYZABLE GROUPS NOVARTIS AG (CH) 2010-01-28 WO disclosed
US-20100014047-A1 Silicone-Containing Polymeric Materials with Hydrolyzable Groups ALCON INC. (CH) 2010-01-21 US disclosed