SCHEMBL5645680

SCHEMBL5645680

CSc1ccc([S+](c2ccccc2)c2ccccc2)cc1.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CCC1C2

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HSD17B10 Q99714 1/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL383093 0.90 L3MBTL1 (0.35) MEN1KMT2AHSD17B10TSHRALDH1A1
SCHEMBL448748 0.87 ALDH1A1 (0.33) MEN1KMT2AHSD17B10TSHRALDH1A1
SCHEMBL5651472 0.87 ESR2 (0.32) ALDH1A1
SCHEMBL678432 0.86 HSD11B1 (0.37) ALDH1A1
SCHEMBL5649250 0.86 MAOA (0.30)
SCHEMBL447065 0.82 LMNA (0.37) MEN1KMT2AHSD17B10TSHRALDH1A1
SCHEMBL5649768 0.82 MMP8 (0.32)
SCHEMBL678084 0.81 HSD11B1 (0.40) ALDH1A1
SCHEMBL5651655 0.77 PIK3CD (0.32)
SCHEMBL445082 0.77 HPGD (0.36) MEN1KMT2AHSD17B10TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7217492-B2 Onium salt compound and radiation-sensitive resin composition JSR CORPORATION (JP) 2007-05-15 US disclosed
US-20050053861-A1 Onium salt compound and radiation-sensitive resin composition JSR CORPORATION (JP) 2005-03-10 US disclosed