SCHEMBL19042425

SCHEMBL19042425

NS(=O)(=O)C(F)(F)C(=O)OC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.41
CYP19A1 P11511 4/20 0.38
CYP17A1 P05093 3/20 0.38
NPSR1 Q6W5P4 2/20 0.35
TSHR P16473 1/20 0.35
NAAA Q02083 1/20 0.33
STS P08842 2/20 0.31
EPHX2 P34913 1/20 0.31
CA12 O43570 3/20 0.31
CA9 Q16790 3/20 0.31
CA7 P43166 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA1 P00915 1/20 0.30
THRB P10828 1/20 0.30
CYP2C9 P11712 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
SCHEMBL686582 0.86 CYP19A1 (0.40) CA2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL10168175 0.83 CYP19A1 (0.41) CA2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL17522547 0.82 CYP19A1 (0.37) CA2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL17525074 0.82 CYP19A1 (0.37) CA2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL17068034 0.81 CYP19A1 (0.39) CA2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL9764361 0.78 CYP19A1 (0.43) CA2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL17522560 0.77 TSHR (0.40) CA2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL14294660 0.77 ALDH1A1 (0.35) CA2CYP19A1CYP17A1
SCHEMBL21392229 0.76 CYP19A1 (0.34) CA2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL17522556 0.76 EPHX2 (0.38) CA2CYP19A1CYP17A1NPSR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230359119-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-09 US disclosed
US-20170184962-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-29 US disclosed
US-20170184964-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-29 US disclosed
US-20170184963-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-29 US disclosed