SCHEMBL14955951

SCHEMBL14955951

O=S(=O)(c1ccc(-c2ccccc2F)cc1)c1ccc(-c2ccccc2F)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.52
PTGS1 P23219 2/20 0.52
PTPRC P08575 1/20 0.52
PTPN1 P18031 1/20 0.52
GRIA4 P48058 5/20 0.48
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SCD O00767 3/20 0.47
FADS1 O60427 1/20 0.47
HTR6 P50406 1/20 0.46

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
SCHEMBL9206986 0.84 PTGS2 (0.73) PTGS2PTGS1SCDFADS1
SCHEMBL14119978 0.84 ALDH1A1 (0.50) PTGS2PTGS1PTPRCPTPN1GRIA4
SCHEMBL4802143 0.84 PTGS1 (0.73) PTGS2PTGS1SCD
SCHEMBL2891953 0.84 TSHR (0.50) PTGS2PTGS1PTPRCPTPN1GRIA4
SCHEMBL12856701 0.82 PTPRC (0.56) PTPRCPTPN1GRIA4NPSR1ALDH1A1
SCHEMBL5524387 0.76 VCAM1 (0.46) PTGS2PTGS1HTR6
SCHEMBL4126597 0.76 PTGS2 (0.46) PTGS2PTGS1MAPTHTR6
SCHEMBL7087907 0.76 PTGS2 (0.61) PTGS2PTGS1GRIA4SCDFADS1
SCHEMBL2647000 0.76 PTPRC (0.52) PTPRCPTPN1GRIA4NPSR1ALDH1A1
SCHEMBL1271133 0.75 ALDH1A1 (0.58) PTGS2PTGS1ALDH1A1L3MBTL1HTR6

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-9000123-B2 Polymer, method for manufacturing the same, and film JSR CORPORATION (JP) 2015-04-07 US disclosed
US-20130130012-A1 NOVEL POLYMER, METHOD FOR MANUFACTURING THE SAME, AND FILM JSR CORPORATION (JP) 2013-05-23 US disclosed