SCHEMBL26312950

SCHEMBL26312950

C=C(C)C(=O)Oc1ccc(I)c(C(=O)OCCCCC(=O)OCCS(=O)(=O)O)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
ESR1 P03372 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ELANE P08246 1/20 0.31
EPHX2 P34913 1/20 0.31
TSHR P16473 2/20 0.30
L3MBTL1 Q9Y468 2/20 0.30
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL26312949 0.97 TDP1 (0.35) TDP1POLBAPEX1HTTESR1
SCHEMBL26312948 0.93 ELANE (0.32) TDP1POLBAPEX1HTTKMT2A
SCHEMBL26312876 0.85 POLB (0.32) TDP1POLBAPEX1HTT
SCHEMBL26312875 0.82 POLB (0.31) TDP1POLBAPEX1HTT
SCHEMBL26312874 0.78 ELANE (0.30) ELANE
SCHEMBL26312951 0.77 ALDH1A1 (0.30) HTTKMT2A
SCHEMBL12376766 0.73 ELANE (0.50) TDP1POLBAPEX1HTTESR1
SCHEMBL12376762 0.73 ELANE (0.42) TDP1POLBAPEX1HTTESR1
SCHEMBL26312929 0.73 ESR1 (0.39) TDP1POLBAPEX1HTTESR1
SCHEMBL26312810 0.71 SERPINE1 (0.47) TDP1ESR1MEN1KMT2AELANE

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-20230296981-A1 RESIST MATERIAL AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-21 US disclosed
US-20230296980-A1 RESIST MATERIAL AND PATTERN FORMING METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-09-21 US disclosed