SCHEMBL29315871

SCHEMBL29315871

C=C(C)C(=O)OCCOC(=O)Oc1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.47
APEX1 P27695 1/20 0.47
HTT P42858 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
THRB P10828 1/20 0.45
ELANE P08246 1/20 0.42
KMT2A Q03164 4/20 0.40
TSHR P16473 2/20 0.40
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL12404362 0.96 THRB (0.49) CA1CA2LMNAPOLBAPEX1
SCHEMBL12404381 0.96 THRB (0.49) CA1CA2LMNAPOLBAPEX1
SCHEMBL29315866 0.94 POLB (0.55) CA1CA2LMNAPOLBAPEX1
SCHEMBL29315869 0.94 TDP1 (0.51) CA1CA2LMNAPOLBAPEX1
SCHEMBL29315878 0.93 POLB (0.57) CA1CA2LMNAPOLBAPEX1
SCHEMBL29315876 0.93 POLB (0.57) CA1CA2LMNAPOLBAPEX1
SCHEMBL10885204 0.89 POLB (0.48) CA1CA2LMNAPOLBAPEX1
P-Xylene SCHEMBL11360520 0.87 THRB (0.57) CA1CA2LMNAPOLBAPEX1
SCHEMBL25237883 0.86 POLB (0.52) LMNAPOLBAPEX1HTTTDP1
SCHEMBL3561624 0.86 ELANE (0.50) CA1CA2LMNAPOLBAPEX1

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
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed