SCHEMBL12242522

SCHEMBL12242522

C=CC(=O)COc1ccc(C#Cc2ccc(C#Cc3ccc(OCOC(=O)C=C)cc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.45
THRB P10828 3/20 0.43
ACACB O00763 9/20 0.40
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 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
SCHEMBL12242480 1.00 FFAR1 (0.45) FFAR1THRBACACBGLAGAA
SCHEMBL12242493 0.96 FFAR1 (0.42) FFAR1THRBACACBRAB9ASMN1; SMN2
SCHEMBL16788455 0.93 THRB (0.42) FFAR1THRBACACBHPGDTSHR
SCHEMBL12242488 0.91 FFAR1 (0.39) FFAR1THRBACACBHTTRAB9A
SCHEMBL12733803 0.91 THRB (0.50) FFAR1THRBACACBHPGDTSHR
SCHEMBL12242511 0.90 FFAR1 (0.38) FFAR1THRBACACB
SCHEMBL12242566 0.89 FFAR1 (0.39) FFAR1THRBACACB
SCHEMBL12242503 0.88 FFAR1 (0.40) FFAR1THRBACACBGAARAB9A
SCHEMBL12242532 0.88 FFAR1 (0.40) FFAR1THRBACACBGAARAB9A
SCHEMBL12242525 0.88 KMT2A (0.40) FFAR1THRBHTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8460576-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-06-11 US disclosed
US-20110253936-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-10-20 US disclosed