SCHEMBL1040066

SCHEMBL1040066

COC(=O)CC(O)CC(O)/C=C/C=C(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.40
KCNA5 P22460 3/20 0.39
TBXAS1 P24557 1/20 0.38
KMT2A Q03164 1/20 0.38
ESRRB O95718 1/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL1660809 1.00 AKT1 (0.40) AKT1KCNA5TBXAS1KMT2AESRRB
SCHEMBL1660808 1.00 AKT1 (0.40) AKT1KCNA5TBXAS1KMT2AESRRB
SCHEMBL1040067 1.00 AKT1 (0.40) AKT1KCNA5TBXAS1KMT2AESRRB
SCHEMBL9421149 0.85 HMGCR (0.39)
SCHEMBL6320596 0.85 HMGCR (0.39)
SCHEMBL6900099 0.85 HMGCR (0.39)
SCHEMBL6900093 0.85 HMGCR (0.39)
SCHEMBL9420672 0.79 CNR2 (0.40)
SCHEMBL9420668 0.79 CNR2 (0.40)
SCHEMBL9735655 0.76 KMT2A (0.40) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9259872-B2 Multiparticulates EURO-CELTIQUE S.A. (LU) 2016-02-16 US claimed
US-9259872-B2 Multiparticulates EURO-CELTIQUE S.A. (LU) 2016-02-16 US disclosed
CN-103462904-A Multiparticulates of preferably an opioid, and method of manufacturing using extrusion EURO CELTIQUE SA 2013-12-25 CN disclosed
EP-2269582-A2 Multiparticulates of preferably an opioid, and method of manufacturing using extrusion EURO-CELTIQUE S.A. (LU) 2011-01-05 EP disclosed
US-20080260815-A1 Extruded with water permeability modifier and platicizer that also acts as lubricant; pH independent release profile; opioid controlled release EURO-CELTIQUE S.A. (LU) 2008-10-23 US disclosed
CN-101052379-A Multiparticulates of preferably opioids and manufacturing process using extrusion EURO CELTIQUE SA (LU) 2007-10-10 CN disclosed
EP-1809249-A2 MULTIPARTICULATES OF PREFERABLY AN OPIOID, AND METHOD OF MANUFACTURING USING EXTRUSION Euroceltique S.A. (LU) 2007-07-25 EP disclosed
WO-2006024881-A2 MULTIPARTICULATES OF PREFERABLY AN OPIOID, AND METHOD OF MANUFACTURING USING EXTRUSION EURO-CELTIQUE S.A. (LU) 2006-03-09 WO disclosed