SCHEMBL448243

SCHEMBL448243

CCCCCC(C=C(C)C(=O)O)N=C=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
GPR84 Q9NQS5 7/20 0.37
FFAR1 O14842 3/20 0.37
FFAR4 Q5NUL3 2/20 0.34
ACE2 Q9BYF1 1/20 0.34
ZDHHC7 Q9NXF8 1/20 0.33
CA1 P00915 1/20 0.33
FAAH O00519 1/20 0.33
GRIK1 P39086 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
GRIK2 Q13002 1/20 0.33

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
SCHEMBL445918 0.98 MAPT (0.42) MAPTLCKPPARDZDHHC20ZDHHC2
SCHEMBL448596 0.95 CA2 (0.35) MAPTLCKPPARDZDHHC20ZDHHC2
SCHEMBL451026 0.90 CHRM1 (0.32)
SCHEMBL3166697 0.83
SCHEMBL449847 0.83
SCHEMBL1702508 0.74 LCK (0.50) MAPTLCKPPARDZDHHC20ZDHHC2
SCHEMBL943388 0.74 FFAR1 (0.47) MAPTLCKPPARDZDHHC20ZDHHC2
SCHEMBL18173540 0.74 LCK (0.55) MAPTLCKPPARDZDHHC20ZDHHC2
SCHEMBL11661583 0.74 LCK (0.50) MAPTLCKPPARDZDHHC20ZDHHC2
SCHEMBL2350390 0.74 LCK (0.50) MAPTLCKPPARDZDHHC20ZDHHC2

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 8 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
EP-0181281-A1 Fluoroalkylcarbamyl acrylates and methacrylates CIBA-GEIGY AG (CH) 1986-05-14 EP disclosed