SCHEMBL25636802

SCHEMBL25636802

O=C1C2CCC3(OC(=O)C(F)(F)S(=O)(=O)O)CC(C2)CC1C3

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX2 P34913 2/20 0.35
CYP17A1 P05093 1/20 0.30
CYP19A1 P11511 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
SCHEMBL547287 0.91 TSHR (0.52) TSHRNPSR1EPHX2CYP17A1CYP19A1
SCHEMBL19261603 0.91 TSHR (0.52) TSHRNPSR1EPHX2CYP17A1CYP19A1
SCHEMBL786684 0.83 TSHR (0.48) TSHRNPSR1EPHX2CYP17A1CYP19A1
SCHEMBL13888917 0.82
SCHEMBL10150821 0.81 TSHR (0.51) TSHRNPSR1EPHX2CYP17A1CYP19A1
SCHEMBL786499 0.81 TSHR (0.48) TSHRNPSR1EPHX2CYP17A1CYP19A1
SCHEMBL6399938 0.80 EP300 (0.30)
SCHEMBL2605905 0.79 TSHR (0.53) TSHRNPSR1EPHX2CYP17A1CYP19A1
SCHEMBL16131651 0.79 TSHR (0.49) TSHRNPSR1EPHX2CYP17A1CYP19A1
SCHEMBL10203472 0.79 TSHR (0.49) TSHRNPSR1EPHX2CYP17A1CYP19A1

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-11675267-B2 Resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-06-13 US disclosed