SCHEMBL8916745

SCHEMBL8916745

O=S(=O)(O)c1ccc(CCC(F)(F)C(F)F)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.39
CA1 P00915 5/20 0.39
LMNA P02545 1/20 0.38
ALDH1A1 P00352 5/20 0.37
TSHR P16473 4/20 0.37
NT5E P21589 1/20 0.37
F2 P00734 2/20 0.36
TMPRSS4 Q9NRS4 2/20 0.36
TP53 P04637 2/20 0.36
CA12 O43570 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL778771 0.82 LMNA (0.43) CA2CA1LMNAALDH1A1TSHR
SCHEMBL775755 0.79 LMNA (0.41) CA2CA1LMNAALDH1A1TSHR
SCHEMBL21644984 0.78 CA2 (0.41) CA2CA1LMNAALDH1A1TSHR
SCHEMBL10377765 0.77 CA1 (0.41) CA2CA1LMNAALDH1A1TSHR
SCHEMBL776683 0.76 LMNA (0.45) CA2CA1LMNAALDH1A1TSHR
SCHEMBL11583429 0.75 LMNA (0.56) CA2CA1LMNAALDH1A1TSHR
SCHEMBL658697 0.75 LMNA (0.43) CA2CA1LMNAALDH1A1TSHR
SCHEMBL20164792 0.75 CA2 (0.45) CA2CA1LMNAALDH1A1TSHR
SCHEMBL9697268 0.73 LMNA (0.38) CA2CA1LMNAALDH1A1TSHR
SCHEMBL776514 0.72 TSHR (0.48) CA2CA1LMNAALDH1A1TSHR

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5618781-A CONSISTS OF 1,3-DICHLORO-1,1,2,2,3-PENTAFLUOROPROPANE AND 2-METHYLPENTANE ALLIEDSIGNAL INC. (US) 1997-04-08 US disclosed
EP-0728752-A1 Triazole compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-08-28 EP disclosed
US-5405861-A Fungicides TAKEDA CHEMICAL INDUSTRIES, CO., LTD. (JP) 1995-04-11 US disclosed
EP-0494876-B1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE AND A HYDROCARBON CONTAINING SIX CARBON ATOMS ALLIED SIGNAL INC (US) 1994-10-26 EP disclosed
EP-0532713-B1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE, METHANOL AND A HYDROCARBON CONTAINING SIX CARBON ATOMS ALLIED SIGNAL INC (US) 1994-09-14 EP disclosed
US-5288819-A Cleaning, defluxing compounds ALLIEDSIGNAL INC. (US) 1994-02-22 US disclosed
EP-0494975-B1 AZEOTROPE-LIKE COMPOSITIONS OF 1,3-DICHLORO-1,1,2,2,3-PENTAFLUOROPROPANE AND 2-METHYL-2-PROPANOL ALLIED SIGNAL INC (US) 1994-02-02 EP disclosed
EP-0532713-A1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE, METHANOL AND A HYDROCARBON CONTAINING SIX CARBON ATOMS. ALLIED SIGNAL INC (US) 1993-03-24 EP disclosed
EP-0494876-A1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE AND A HYDROCARBON CONTAINING SIX CARBON ATOMS. ALLIED SIGNAL INC (US) 1992-07-22 EP disclosed
EP-0494975-A1 AZEOTROPE-LIKE COMPOSITIONS OF 1,3-DICHLORO-1,1,2,2,3-PENTAFLUOROPROPANE AND 2-METHYL-2-PROPANOL. ALLIED SIGNAL INC (US) 1992-07-22 EP disclosed
US-5104565-A Cleaning compounds ALLIED-SIGNAL INC. (US) 1992-04-14 US disclosed
WO-1992000402-A2 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE, 2-PROPANOL AND A HYDROCARBON CONTAINING SIX CARBON ATOMS ALLIED-SIGNAL INC. (US) 1992-01-09 WO disclosed
WO-1991018967-A1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE, ETHANOL AND 1,2-DICHLOROETHYLENE ALLIED-SIGNAL INC. (US) 1991-12-12 WO disclosed
WO-1991019019-A1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE, METHANOL AND 1,2-DICHLOROETHYLENE ALLIED-SIGNAL INC. (US) 1991-12-12 WO disclosed
WO-1991018965-A1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE, METHANOL AND A HYDROCARBON CONTAINING SIX CARBON ATOMS ALLIED-SIGNAL INC. (US) 1991-12-12 WO disclosed
WO-1991009988-A1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE, ETHANOL AND A HYDROCARBON CONTAINING SIX CARBON ATOMS ALLIED-SIGNAL INC. (US) 1991-07-11 WO disclosed
WO-1991005035-A1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE AND AN ALKANOL HAVING 1-4 CARBON ATOMS ALLIED-SIGNAL INC. (US) 1991-04-18 WO disclosed
WO-1991005082-A1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE AND 1,2-DICHLOROETHYLENE ALLIED-SIGNAL INC. (US) 1991-04-18 WO disclosed
WO-1991005083-A1 AZEOTROPE-LIKE COMPOSITIONS OF DICHLOROPENTAFLUOROPROPANE AND A HYDROCARBON CONTAINING SIX CARBON ATOMS ALLIED-SIGNAL INC. (US) 1991-04-18 WO disclosed
EP-0421210-A2 Triazole compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1991-04-10 EP disclosed