SCHEMBL29316023

SCHEMBL29316023

C=C(C)C(=O)OCCCCCOC(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.59
POLB P06746 1/20 0.59
APEX1 P27695 1/20 0.59
HTT P42858 1/20 0.59
TSHR P16473 3/20 0.50
KDM4E B2RXH2 1/20 0.49
CNR2 P34972 1/20 0.47
NPC1 O15118 2/20 0.47
MAPT P10636 2/20 0.47
RAB9A P51151 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.46
SLC1A5 Q15758 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44

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
SCHEMBL29316026 1.00 TDP1 (0.59) TDP1POLBAPEX1HTTTSHR
SCHEMBL29316022 0.99 TDP1 (0.58) TDP1POLBAPEX1HTTTSHR
SCHEMBL29316020 0.96 TDP1 (0.54) TDP1POLBAPEX1HTTTSHR
SCHEMBL116940 0.93 KDM4E (0.53) TDP1POLBAPEX1HTTKDM4E
SCHEMBL28351135 0.91 TDP1 (0.69) TDP1POLBAPEX1HTTTSHR
SCHEMBL9647846 0.91 TDP1 (0.69) TDP1POLBAPEX1HTTTSHR
SCHEMBL9647822 0.91 TDP1 (0.69) TDP1POLBAPEX1HTTTSHR
SCHEMBL433570 0.90 TDP1 (0.71) TDP1POLBAPEX1HTTTSHR
SCHEMBL5694166 0.89 TSHR (0.57) TDP1POLBAPEX1HTTTSHR
SCHEMBL19789522 0.89 TDP1 (0.56) TDP1POLBAPEX1HTTTSHR

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