SCHEMBL22277451

SCHEMBL22277451

CN1CCC(C(C)(C)OC(=O)c2cc(I)cc(I)c2I)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.33
SCN1A P35498 3/20 0.32
SCN2A Q99250 3/20 0.32
SCN3A Q9NY46 3/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
SLC6A2 P23975 2/20 0.30
SLC6A4 P31645 2/20 0.30
SLC6A3 Q01959 2/20 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
SCHEMBL22277818 0.93 SLC6A2 (0.34) ATMCHRM4CHRM5CHRM1CHRM3
SCHEMBL22277817 0.87 POLB (0.30)
SCHEMBL22277450 0.86 MAPT (0.42) KMT2AMEN1
SCHEMBL22277441 0.84 POLB (0.30)
SCHEMBL22277824 0.83 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL26426795 0.82 CHRM3 (0.32) CHRM3
SCHEMBL24179407 0.82 DPP4 (0.35)
SCHEMBL22277825 0.81
SCHEMBL22277446 0.81 POLB (0.31)
SCHEMBL22277822 0.81 POLB (0.33)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230129578-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-04-27 US disclosed
US-20230129578-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-04-27 US disclosed
US-20200241417-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-07-30 US disclosed