SCHEMBL11986152

SCHEMBL11986152

C=CC(=O)OCOc1ccc(C(=O)Oc2ccc(S(=O)(=O)c3ccc(OC(=O)c4ccc(OCOC(=O)C=C)cc4F)cc3)cc2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
ALDH1A1 P00352 2/20 0.35
ELANE P08246 1/20 0.34
MAOB P27338 2/20 0.34
GAA P10253 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KAT6A Q92794 1/20 0.34
PARP15 Q460N3 1/20 0.33
PARP10 Q53GL7 1/20 0.33
MAOA P21397 1/20 0.33
KMT2A Q03164 1/20 0.33
THRB P10828 2/20 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
SCHEMBL12154248 0.92 MAOB (0.39) ALDH1A1MAOBPARP15PARP10MAOA
SCHEMBL12840940 0.90 THRB (0.45) POLBMAPTPKMALDH1A1ELANE
SCHEMBL12840939 0.89 THRB (0.39) POLBMAPTPKMALDH1A1KMT2A
SCHEMBL16425358 0.88 TSHR (0.40) POLBMAPTPKMALDH1A1KMT2A
SCHEMBL13962708 0.88 TSHR (0.40) POLBMAPTPKMALDH1A1KMT2A
SCHEMBL12154308 0.87 GAA (0.39) POLBMAPTPKMALDH1A1ELANE
SCHEMBL11986156 0.86 MAOB (0.33) MAOBGAANPSR1KAT6APARP15
SCHEMBL12154246 0.86 ESR1 (0.43) POLBMAPTMAOBPARP15PARP10
SCHEMBL14026827 0.86 HPGD (0.43) KMT2ATHRB
SCHEMBL14117072 0.85 POLB (0.44) POLBMAPTPKMALDH1A1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9315728-B2 Polymerizable liquid crystal composition and homogeneous-aligned liquid crystal film JNC CORPORATION (JP) 2016-04-19 US disclosed
US-8419973-B2 Polymerizable liquid crystal composition and homeotropically-aligned liquid crystal film JNC CORPORATION (JP) 2013-04-16 US disclosed
US-8246855-B2 Polymerizable liquid crystal composition and optically anisotropic film using the same JNC CORPORATION (JP) 2012-08-21 US disclosed
US-20100151154-A1 Polymerizable liquid crystal composition and homeotropically-aligned liquid crystal film CHISSO CORPORATION 2010-06-17 US disclosed
US-20100143612-A1 Polymerizable liquid crystal composition and homogeneous-aligned liquid crystal film CHISSO CORPORATION 2010-06-10 US disclosed
US-20100051866-A1 Polymerizable liquid crystal composition and optically anisotropic film using the same JNC PETROCHEMICAL CORPORATION (JP) 2010-03-04 US disclosed