SCHEMBL7719984

SCHEMBL7719984

C=C(C)C(=O)OCCC(=O)N1C(=O)CCC1=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.42
TSHR P16473 3/20 0.41
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 2/20 0.37
POLB P06746 2/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL2036447 0.77 THRB (0.44) THRBTSHRKMT2AATMALDH1A1
SCHEMBL10889100 0.75 SMN1; SMN2 (0.42) KMT2AALDH1A1POLBAPEX1HTT
SCHEMBL12922819 0.74 TSHR (0.49) THRBTSHRKMT2AATMALDH1A1
SCHEMBL1311659 0.73 THRB (0.41) THRBTSHRKMT2AATMALDH1A1
SCHEMBL8898726 0.73 KMT2A (0.44) THRBTSHRKMT2AATMALDH1A1
Ethylene SCHEMBL8506065 0.72 THRB (0.71) THRBTSHRALDH1A1POLBAPEX1
Ethylene SCHEMBL632736 0.72 THRB (0.71) THRBTSHRALDH1A1POLBAPEX1
Ethylene SCHEMBL619217 0.72 THRB (0.71) THRBTSHRALDH1A1POLBAPEX1
Ethylene SCHEMBL955493 0.72 THRB (0.71) THRBTSHRALDH1A1POLBAPEX1
Ethylene SCHEMBL9485953 0.72 THRB (0.71) THRBTSHRALDH1A1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002363158-A METHOD FOR PRODUCING (METH)ACRYLIC COMPOUND AND (METH) ACRYLIC COMPOUND MITSUBISHI RAYON CO LTD 2002-12-18 JP disclosed