SCHEMBL16170472

SCHEMBL16170472

C=CC(=O)Sc1ccc(C#Cc2ccc(SC(=O)C(=C)C)cc2F)cc1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.35
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
HAO1 Q9UJM8 3/20 0.32

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
SCHEMBL16170746 1.00 ACACB (0.35) ACACBFFAR1FFAR4HAO1
SCHEMBL16170514 0.92 ACACB (0.40) ACACBFFAR1FFAR4HAO1
SCHEMBL16170532 0.91 FFAR1 (0.39) ACACBFFAR1FFAR4HAO1
SCHEMBL16170470 0.87 FFAR1 (0.35) ACACBFFAR1FFAR4
SCHEMBL16170471 0.87 FFAR1 (0.35) ACACBFFAR1FFAR4
SCHEMBL16170490 0.87 ACACB (0.35) ACACBFFAR1
SCHEMBL16170625 0.86 FFAR1 (0.33) ACACBFFAR1
SCHEMBL16170585 0.86 FFAR1 (0.33) ACACBFFAR1
SCHEMBL16170582 0.83 ACACB (0.33) ACACB
SCHEMBL16170508 0.83 ACACB (0.33) ACACB

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
US-9382353-B2 Polymerizable compound having thioester group, polymerizable composition and liquid crystal display device JNC CORPORATION (JP) 2016-07-05 US disclosed
US-9382353-B2 Polymerizable compound having thioester group, polymerizable composition and liquid crystal display device JNC CORPORATION (JP) 2016-07-05 US disclosed
US-20140306157-A1 POLYMERIZABLE COMPOUND HAVING THIOESTER GROUP, POLYMERIZABLE COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-10-16 US disclosed
US-20140306157-A1 POLYMERIZABLE COMPOUND HAVING THIOESTER GROUP, POLYMERIZABLE COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2014-10-16 US disclosed