SCHEMBL9913281

SCHEMBL9913281

CC1CC2CC(OC(=O)C(F)(F)S)(C1)CC(C)C2=O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL10154044 0.79 TSHR (0.53) TSHRNPSR1
SCHEMBL26011995 0.71 TSHR (0.51) TSHRNPSR1
SCHEMBL14308868 0.68 TSHR (0.30) TSHRNPSR1
SCHEMBL685366 0.68 TSHR (0.53) TSHRNPSR1
SCHEMBL685847 0.68 TSHR (0.53) TSHRNPSR1
SCHEMBL13888917 0.68
SCHEMBL685848 0.66 TSHR (0.51) TSHRNPSR1
SCHEMBL26061863 0.66 TSHR (0.51) TSHRNPSR1
SCHEMBL12345921 0.64 NPSR1 (0.52) TSHRNPSR1
SCHEMBL26061829 0.64 TSHR (0.49) TSHRNPSR1

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
WO-2012074122-A1 NEGATIVE PATTERN FORMING METHOD AND RESIST PATTERN FUJIFILM CORPORATION (JP) 2012-06-07 WO disclosed