SCHEMBL7754438

SCHEMBL7754438

Cc1ccc(S(=O)(=O)OCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PSMD10 O75832 1/20 0.37
CA1 P00915 5/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
ALDH1A1 P00352 5/20 0.35
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
CA2 P00918 5/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CYP24A1 Q07973 2/20 0.32
STAT3 P40763 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CASP3 P42574 1/20 0.30
CASP7 P55210 1/20 0.30
MAPT P10636 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
SCHEMBL6853749 0.93 ALDH1A1 (0.38) PSMD10CA1CA12CA9ALDH1A1
SCHEMBL6852562 0.93 ALDH1A1 (0.38) PSMD10CA1CA12CA9ALDH1A1
SCHEMBL6849019 0.88 PSMD10 (0.37) PSMD10CA1CA12CA9ALDH1A1
SCHEMBL6849012 0.88 PSMD10 (0.37) PSMD10CA1CA12CA9ALDH1A1
SCHEMBL5531391 0.87 PSMD10 (0.38) PSMD10CA1CA12CA9ALDH1A1
SCHEMBL7756826 0.86 CA1 (0.35) PSMD10CA1CA12CA9ALDH1A1
SCHEMBL5369470 0.85 CA1 (0.39) PSMD10CA1CA12CA9ALDH1A1
SCHEMBL5365715 0.85 CA1 (0.39) PSMD10CA1CA12CA9ALDH1A1
SCHEMBL7755223 0.85 CA1 (0.34) PSMD10CA1CA12CA9ALDH1A1
SCHEMBL3343193 0.84 ALDH1A1 (0.39) PSMD10CA1CA12CA9ALDH1A1

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
EP-0792255-B1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING & MFG (US) 2001-02-28 EP disclosed
EP-0792255-A1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-09-03 EP disclosed
WO-1996015092-A1 LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-05-23 WO disclosed
US-5482650-A Liquid crystal compounds having perfluoroether terminal portions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-09 US disclosed