SCHEMBL26312949

SCHEMBL26312949

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

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.35
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.32
ESR1 P03372 2/20 0.31
ELANE P08246 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31
BRD4 O60885 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
SCHEMBL26312950 0.97 TDP1 (0.36) TDP1POLBAPEX1HTTL3MBTL1
SCHEMBL26312948 0.94 ELANE (0.32) TDP1POLBAPEX1HTTELANE
SCHEMBL26312875 0.85 POLB (0.31) TDP1POLBAPEX1HTT
SCHEMBL26312876 0.82 POLB (0.32) TDP1POLBAPEX1HTT
SCHEMBL26312874 0.79 ELANE (0.30) ELANE
SCHEMBL26312951 0.77 ALDH1A1 (0.30) HTTKMT2A
SCHEMBL26348282 0.74 TSHR (0.47) TDP1POLBAPEX1HTTL3MBTL1
SCHEMBL12376766 0.74 ELANE (0.50) TDP1POLBAPEX1HTTESR1
SCHEMBL26312929 0.73 ESR1 (0.39) TDP1POLBAPEX1HTTESR1
SCHEMBL12376762 0.73 ELANE (0.42) TDP1POLBAPEX1HTTESR1

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