SCHEMBL13713752

SCHEMBL13713752

OC1CCC(C2(C3CCC(O)CC3)c3ccccc3-c3ccccc32)CC1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 12/20 0.42
KMT2A Q03164 1/20 0.42
THRB P10828 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
APEX1 P27695 1/20 0.36

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
SCHEMBL1394180 0.83 KMT2A (0.40) PDK2KMT2A
SCHEMBL1395101 0.81 PDK2 (0.41) PDK2KMT2A
SCHEMBL30949491 0.79 KMT2A (0.42) PDK2KMT2AAPEX1
SCHEMBL24848654 0.73 PDK2 (0.50) PDK2
SCHEMBL24847564 0.73 PDK2 (0.54) PDK2KMT2A
SCHEMBL1782514 0.72 KMT2A (0.39) PDK2KMT2ATHRBTDP1APEX1
SCHEMBL29508385 0.72 KMT2A (0.39) PDK2KMT2ATHRBTDP1APEX1
SCHEMBL13713753 0.72 PDK2 (0.42) PDK2KMT2AAPEX1
SCHEMBL25280687 0.72 PDK2 (0.41) PDK2KMT2ATHRBTDP1
SCHEMBL25232148 0.70 PDK2 (0.49) PDK2KMT2AAPEX1

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-8859648-B2 Retardation film and polyester resin for optical use TORAY INDUSTRIES, INC. (JP) 2014-10-14 US disclosed
US-20090207490-A1 Retardation film and polyester resin for optical use TORAY INDUSTRIES, INC. (JP) 2009-08-20 US disclosed