SCHEMBL2708403

SCHEMBL2708403

CCC(C)(C)CC(C)(O)CC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL2824036 0.83 TSHR (0.40) TSHRTDP1ALDH1A1
SCHEMBL14479303 0.80 CYP2D6 (0.45)
SCHEMBL987062 0.78 ALDH1A1 (0.39) TSHRTDP1ALDH1A1
SCHEMBL2762967 0.78 ALDH1A1 (0.39) TSHRTDP1ALDH1A1
SCHEMBL11409761 0.78 TSHR (0.44) TSHRTDP1ALDH1A1
SCHEMBL29222451 0.76 FDPS (0.31)
SCHEMBL12515790 0.76
SCHEMBL13827405 0.76
SCHEMBL10794688 0.75 TSHR (0.46) TSHRTDP1ALDH1A1
SCHEMBL23931 0.75

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-2445951-A1 SILICONE HYDROGELS FORMED FROM SYMMETRIC HYDROXYL FUNCTIONALIZED SILOXANES Johnson & Johnson Vision Care, Inc. (US) 2012-05-02 EP disclosed
US-20100331443-A1 SILICONE HYDROGELS FORMED FROM SYMMETRIC HYDROXYL FUNCTIONALIZED SILOXANES JOHNSON & JOHNSON VISION CARE, INC. 2010-12-30 US disclosed
WO-2010151411-A1 SILICONE HYDROGELS FORMED FROM SYMMETRIC HYDROXYL FUNCTIONALIZED SILOXANES JOHNSON & JOHNSON VISION CARE, INC. (US) 2010-12-29 WO disclosed
WO-2010039611-A1 PROCESS FOR FORMING SILICONE HYDROGEL ARTICLES HAVING IMPROVED OPTICAL PROPERTIES JOHNSON & JOHNSON VISION CARE, INC. (US) 2010-04-08 WO disclosed