SCHEMBL9464153

SCHEMBL9464153

C=C(C)C(=O)OCCOCCCCCCOCCOC(=O)C(=C)C

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.68
TSHR P16473 7/20 0.66
HTT P42858 2/20 0.49
POLB P06746 1/20 0.49
APEX1 P27695 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 6/20 0.40
CES2 O00748 2/20 0.39
TP53 P04637 2/20 0.39
HIF1A Q16665 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
CYP3A4 P08684 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
NAAA Q02083 1/20 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
SCHEMBL1991763 0.98 THRB (0.70) THRBTSHRHTTPOLBAPEX1
SCHEMBL3103061 0.96 TSHR (0.71) THRBTSHRHTTPOLBAPEX1
SCHEMBL14706828 0.96 THRB (0.68) THRBTSHRHTTPOLBAPEX1
SCHEMBL8507839 0.94 TSHR (0.74) THRBTSHRHTTPOLBAPEX1
SCHEMBL26735154 0.94 TSHR (0.74) THRBTSHRHTTPOLBAPEX1
SCHEMBL9568827 0.94 THRB (0.70) THRBTSHRHTTPOLBAPEX1
SCHEMBL2742411 0.94 THRB (0.70) THRBTSHRHTTPOLBAPEX1
SCHEMBL5446483 0.94 TSHR (0.74) THRBTSHRHTTPOLBAPEX1
SCHEMBL874556 0.93 TSHR (0.79) THRBTSHRHTTPOLBAPEX1
SCHEMBL19077763 0.93 TSHR (0.79) THRBTSHRHTTPOLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3980510-B1 LIQUID CRYSTAL MIXTURE AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2023-11-08 EP disclosed
EP-1803555-B1 Ink composition, inkjet recording method, producing method of planographic printing plate, and planographic printing plate FUJIFILM CORP (JP) 2017-02-22 EP disclosed
EP-0368657-B1 DENTAL RESTORATIVE MATERIAL KURARAY CO., LTD. (JP) 1993-08-04 EP disclosed
US-5192815-A Ultrafine filler, silane coupling agent, acrylic ester monomer KURARAY CO., LTD. (JP) 1993-03-09 US disclosed
EP-0368657-A2 Dental restorative material KURARAY CO., LTD. (JP) 1990-05-16 EP disclosed