SCHEMBL4396469

SCHEMBL4396469

C=C(C)C(=O)OCCCCCCCCOc1ccc2cc(C(C)=O)c(=O)oc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.59
MAOA P21397 7/20 0.59
GAA P10253 3/20 0.58
ALDH1A1 P00352 2/20 0.58
HPGD P15428 2/20 0.58
CA12 O43570 2/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA4 P22748 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA5B Q9Y2D0 1/20 0.53
HSD11B1 P28845 2/20 0.51
POLB P06746 1/20 0.51
APEX1 P27695 1/20 0.51
HTT P42858 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
SLC16A3 O15427 1/20 0.50
KDM4E B2RXH2 2/20 0.49
GLA P06280 2/20 0.49

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
SCHEMBL4540104 0.93 MAOB (0.60) MAOBMAOAGAAALDH1A1HPGD
SCHEMBL4391527 0.88 ALDH1A1 (0.66) MAOBMAOAALDH1A1HPGDPOLB
SCHEMBL4402618 0.85 MAOB (0.65) MAOBMAOAGAAALDH1A1HPGD
SCHEMBL7906950 0.84 CA12 (0.62) MAOBMAOAGAAALDH1A1HPGD
SCHEMBL7907493 0.84 CA12 (0.62) MAOBMAOAGAAALDH1A1HPGD
SCHEMBL7917207 0.84 CA12 (0.62) MAOBMAOAGAAALDH1A1HPGD
SCHEMBL7917179 0.84 CA12 (0.62) MAOBMAOAGAAALDH1A1HPGD
SCHEMBL18154611 0.84 MAOB (0.64) MAOBMAOAGAAALDH1A1HPGD
SCHEMBL29423660 0.84 MAOB (0.64) MAOBMAOAGAAALDH1A1HPGD
SCHEMBL28823148 0.84 MAOB (0.64) MAOBMAOAGAAALDH1A1HPGD

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-7632906-B2 Polymerizable copolymers for alignment layers ROLIC AG (CH) 2009-12-15 US disclosed
US-7632906-B2 Polymerizable copolymers for alignment layers ROLIC AG (CH) 2009-12-15 US disclosed
US-7632906-B2 Polymerizable copolymers for alignment layers ROLIC AG (CH) 2009-12-15 US disclosed
EP-1644425-B1 POLYMERIZABLE COPOLYMERS FOR ALIGNMENT LAYERS ROLIC AG (CH) 2007-12-26 EP disclosed
US-20070179266-A1 Polymerizable copolymers for alignment layers ROLIC AG (CH) 2007-08-02 US disclosed
US-20070179266-A1 Polymerizable copolymers for alignment layers ROLIC AG (CH) 2007-08-02 US disclosed
US-20070179266-A1 Polymerizable copolymers for alignment layers ROLIC AG (CH) 2007-08-02 US disclosed
EP-1644425-A1 POLYMERIZABLE COPOLYMERS FOR ALIGNMENT LAYERS Rolic AG (CH) 2006-04-12 EP disclosed
WO-2005014677-A1 POLYMERIZABLE COPOLYMERS FOR ALIGNMENT LAYERS ROLIC AG (CH) 2005-02-17 WO disclosed