SCHEMBL29315876

SCHEMBL29315876

C=C(C)C(=O)OCCCCCCOC(=O)Oc1ccc(C)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
APEX1 P27695 1/20 0.57
HTT P42858 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
TSHR P16473 2/20 0.51
LMNA P02545 2/20 0.45
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
ELANE P08246 2/20 0.39
THRB P10828 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 2/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL29315878 1.00 POLB (0.57) POLBAPEX1HTTTDP1TSHR
SCHEMBL29315866 0.99 POLB (0.55) POLBAPEX1HTTTDP1TSHR
SCHEMBL29315869 0.96 TDP1 (0.51) POLBAPEX1HTTTDP1TSHR
SCHEMBL29315871 0.93 CA1 (0.49) POLBAPEX1HTTTDP1TSHR
SCHEMBL12404362 0.89 THRB (0.49) POLBAPEX1HTTTDP1TSHR
SCHEMBL12404381 0.89 THRB (0.49) POLBAPEX1HTTTDP1TSHR
SCHEMBL12895973 0.87 POLB (0.55) POLBAPEX1HTTTDP1TSHR
SCHEMBL13695301 0.87 POLB (0.55) POLBAPEX1HTTTDP1TSHR
SCHEMBL12918799 0.87 HTT (0.74) POLBAPEX1HTTTDP1TSHR
SCHEMBL12114905 0.87 HTT (0.74) POLBAPEX1HTTTDP1TSHR

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