SCHEMBL6929140

SCHEMBL6929140

C=C(C(=O)O[SiH](OCC)OCC)C(C)CCC

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL3183897 0.81
SCHEMBL28000485 0.76 ALDH1A1 (0.41) CA1CYP3A4TSHRNFKB1NPSR1
SCHEMBL28606229 0.72 THRB (0.44) TSHR
SCHEMBL7511905 0.72 FFAR3 (0.33)
SCHEMBL28128807 0.68 CA1 (0.44) CA1TSHR
SCHEMBL3261388 0.68 CHRM1 (0.42) CA1CYP3A4TSHRNFKB1NPSR1
SCHEMBL29059313 0.67 CA1 (0.50) CA1TSHR
SCHEMBL8853585 0.67 CA1 (0.41) CA1CYP3A4TSHR
SCHEMBL3230815 0.66 HSD17B10 (0.39) CA1CYP3A4TSHRNFKB1NPSR1
SCHEMBL28861680 0.66 CA1 (0.48) CA1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1216142-A4 THERMOFORMABLE OPHTHALMIC LENS NOVARTIS AG (CH) 2003-06-11 EP disclosed
EP-1216142-A1 THERMOFORMABLE OPHTHALMIC LENS Wesley Jessen Corporation (US) 2002-06-26 EP disclosed
WO-2001005578-A1 THERMOFORMABLE OPHTHALMIC LENS WESLEY-JESSEN CORPORATION (US) 2001-01-25 WO disclosed