SCHEMBL29315515

SCHEMBL29315515

C=C(C)C(=O)OCCCCCOc1ccccc1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.56
POLB P06746 3/20 0.54
APEX1 P27695 1/20 0.54
HTT P42858 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 7/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
GAA P10253 2/20 0.52
KMT2A Q03164 5/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
MEN1 O00255 3/20 0.49
MAPK1 P28482 1/20 0.49
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 2/20 0.49

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
SCHEMBL29315511 0.96 KDM4E (0.54) KDM4EPOLBAPEX1HTTTDP1
SCHEMBL25123541 0.92 KDM4E (0.53) KDM4ETDP1ALDH1A1SMN1; SMN2GAA
SCHEMBL29550232 0.92 KDM4E (0.55) KDM4EHTTTDP1ALDH1A1SMN1; SMN2
SCHEMBL7524394 0.92 KDM4E (0.55) KDM4EHTTTDP1ALDH1A1SMN1; SMN2
SCHEMBL17679502 0.90 KDM4E (0.50) KDM4EPOLBAPEX1HTTTDP1
SCHEMBL17679501 0.90 KDM4E (0.50) KDM4EPOLBAPEX1HTTTDP1
SCHEMBL29315563 0.88 POLB (0.48) KDM4EPOLBAPEX1HTTTDP1
SCHEMBL29315566 0.88 POLB (0.48) KDM4EPOLBAPEX1HTTTDP1
SCHEMBL25123525 0.88 ALDH1A1 (0.60) KDM4EPOLBTDP1ALDH1A1SMN1; SMN2
SCHEMBL25796435 0.88 ALDH1A1 (0.60) KDM4EPOLBTDP1ALDH1A1SMN1; SMN2

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