SCHEMBL809187

SCHEMBL809187

CC(C)C(=O)Oc1cc(OC(=O)C(C)C)cc(C(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.53
PLA2G2A P14555 1/20 0.43
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
TPMT P51580 1/20 0.40
HSD17B10 Q99714 1/20 0.39
MAPT P10636 1/20 0.39
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
CA3 P07451 1/20 0.38
PKM P14618 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
RXRA P19793 2/20 0.38

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
SCHEMBL19480254 0.91 ELANE (0.46) ELANEPLA2G2AKMT2AMEN1TPMT
SCHEMBL809301 0.85 PLA2G2A (0.41) ELANEPLA2G2AKMT2AMEN1TPMT
SCHEMBL22279621 0.85 PLA2G2A (0.41) ELANEPLA2G2AKMT2AMEN1TPMT
SCHEMBL19473391 0.85 PLA2G2A (0.41) ELANEPLA2G2AKMT2AMEN1TPMT
SCHEMBL809353 0.82 ELANE (0.52) ELANEKMT2AMEN1MAPTCA2
SCHEMBL809379 0.82 ELANE (0.58) ELANEKMT2AHSD17B10RXRALMNA
SCHEMBL417129 0.81 HSD17B10 (0.57) ELANEPLA2G2AKMT2AMEN1TPMT
SCHEMBL12617490 0.80 ELANE (0.75) ELANEKMT2AHSD17B10MAPTCA1
SCHEMBL14567205 0.77 ELANE (0.46) ELANEKMT2AMEN1HSD17B10CA12
SCHEMBL1543332 0.77 HSD17B10 (0.57) ELANEPLA2G2AKMT2AMEN1TPMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170298168-A1 GLUCOSE-BASED BLOCK COPOLYMERS NATIONAL SCIENCE FOUNDATION 2017-10-19 US disclosed
EP-1802726-B1 PHOTOCHROMIC COMPOUNDS COMPRISING POLYMERIC SUBSTITUENTS AND METHODS FOR PREPARATION AND USE THEREOF ADVANCED POLYMERIK PTY LTD (AU) 2011-11-30 EP disclosed
EP-1802726-B1 PHOTOCHROMIC COMPOUNDS COMPRISING POLYMERIC SUBSTITUENTS AND METHODS FOR PREPARATION AND USE THEREOF ADVANCED POLYMERIK PTY LTD (AU) 2011-11-30 EP disclosed
US-20090093601-A1 Photochromic Compounds Comprising Polymeric Substituents And Methods For Preparation And Use Thereof POLYMERS AUSTRALIA PTY LIMITED (AU) 2009-04-09 US disclosed
US-20090093601-A1 Photochromic Compounds Comprising Polymeric Substituents And Methods For Preparation And Use Thereof POLYMERS AUSTRALIA PTY LIMITED (AU) 2009-04-09 US disclosed
US-20090093601-A1 Photochromic Compounds Comprising Polymeric Substituents And Methods For Preparation And Use Thereof POLYMERS AUSTRALIA PTY LIMITED (AU) 2009-04-09 US disclosed
EP-1802726-A4 PHOTOCHROMIC COMPOUNDS COMPRISING POLYMERIC SUBSTITUENTS AND METHODS FOR PREPARATION AND USE THEREOF POLYMERS AUSTRALIA PTY LTD (AU) 2008-04-30 EP disclosed
EP-1802726-A1 PHOTOCHROMIC COMPOUNDS COMPRISING POLYMERIC SUBSTITUENTS AND METHODS FOR PREPARATION AND USE THEREOF Polymers Australia PTY Limited (AU) 2007-07-04 EP disclosed
WO-2006024099-A1 PHOTOCHROMIC COMPOUNDS COMPRISING POLYMERIC SUBSTITUENTS AND METHODS FOR PREPARATION AND USE THEREOF POLYMERS AUSTRALIA PTY LIMITED (AU) 2006-03-09 WO disclosed