SCHEMBL25736736

SCHEMBL25736736

CC(C)(C)OC(=O)NCCOCCOC(=O)CS

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
CA12 O43570 5/20 0.43
CA1 P00915 5/20 0.43
CA2 P00918 5/20 0.43
CA9 Q16790 5/20 0.43
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
IDO1 P14902 2/20 0.41
BCHE P06276 1/20 0.40
CNR2 P34972 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
SUCNR1 Q9BXA5 2/20 0.38
ADRB2 P07550 1/20 0.38
HTR1A P08908 1/20 0.38
EPHX1 P07099 1/20 0.38
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL25736731 0.91 TDP1 (0.49) TDP1CA12CA1CA2CA9
SCHEMBL25736711 0.88 TDP1 (0.42) TDP1CA12CA1CA2CA9
SCHEMBL18360370 0.88 TDP1 (0.46) TDP1CA12CA1CA2CA9
SCHEMBL18354616 0.86 TDP1 (0.45) TDP1CA12CA1CA2CA9
SCHEMBL22276641 0.85 TDP1 (0.56) TDP1CA12CA1CA2CA9
SCHEMBL12885084 0.85 TDP1 (0.56) TDP1CA12CA1CA2CA9
SCHEMBL22276648 0.85 TDP1 (0.56) TDP1CA12CA1CA2CA9
SCHEMBL25736733 0.84 CA12 (0.56) TDP1CA12CA1CA2CA9
SCHEMBL31681279 0.84 TDP1 (0.49) TDP1CA12CA1CA2CA9
SCHEMBL13055393 0.83 TDP1 (0.58) TDP1CA12CA1CA2CA9

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-20230152698-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed
US-20230152698-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed