SCHEMBL26807887

SCHEMBL26807887

CN1C(C)(C)CC(OC(=O)C2CCC(OC(=O)c3cc(I)cc(I)c3O)CC2)CC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SERPINE1 P05121 1/20 0.33
▸ TSHR P16473 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ HTT P42858 1/20 0.31

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
SCHEMBL26812127 0.92 GAA (0.39) SERPINE1TSHRGAAHTT
SCHEMBL26807630 0.91 TSHR (0.32) TSHRATMGAAHTT
SCHEMBL26807585 0.90 TSHR (0.36) SERPINE1TSHRATMGAAHTT
SCHEMBL26807889 0.80 — —
SCHEMBL26427858 0.80 TSHR (0.37) TSHRATMGAAHTT
SCHEMBL26807865 0.79 — —
SCHEMBL26807892 0.78 TSHR (0.39) TSHRGAAHTT
SCHEMBL26807851 0.78 CYP2D6 (0.31) —
SCHEMBL26807771 0.77 TTR (0.34) —
SCHEMBL26807893 0.77 TSHR (0.34) TSHRGAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11829067-B2 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-28 — — US disclosed
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