SCHEMBL103307

SCHEMBL103307

C=Cc1ccc(OCOc2ccc(OC(=O)c3ccc(C=C)cc3)cc2Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.36
MAPT P10636 6/20 0.35
KMT2A Q03164 5/20 0.35
GFER P55789 1/20 0.35
MRGPRX4 Q96LA9 3/20 0.35
HTT P42858 1/20 0.34
RAB9A P51151 2/20 0.34
MEN1 O00255 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NPC1 O15118 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL102853 0.85 TDP1 (0.39) HPGDMAPTKMT2AGFERTDP1
SCHEMBL103294 0.84 KMT2A (0.47) MAPTKMT2AGFERRAB9ANPC1
SCHEMBL13310808 0.84 KMT2A (0.47) MAPTKMT2AGFERRAB9ANPC1
SCHEMBL13032731 0.83 KMT2A (0.48) MAPTKMT2AGFERRAB9AMEN1
SCHEMBL103525 0.81 CA9 (0.40) MAPTKMT2ARAB9AMEN1TDP1
SCHEMBL12931943 0.81 HPGD (0.36) HPGDMAPTKMT2AMRGPRX4RAB9A
SCHEMBL13774490 0.81 KMT2A (0.42) MAPTKMT2AGFERRAB9AMEN1
SCHEMBL13390123 0.80 NPC1 (0.38) MAPTKMT2AGFERRAB9AMEN1
SCHEMBL15583453 0.80 THRB (0.37) HPGDMAPTKMT2AMRGPRX4HTT
SCHEMBL13310797 0.77 MAPT (0.46) HPGDMAPTKMT2ARAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8992796-B2 Polymerizable liquid crystal composition DIC CORPORATION (JP) 2015-03-31 US disclosed
US-20120056129-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION DIC CORPORATION (JP) 2012-03-08 US disclosed