SCHEMBL8419685

SCHEMBL8419685

COC(=O)CCCc1ccc(C(CCC(F)(F)C(F)(F)C(F)(F)F)NS(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 3/20 0.42
TBXAS1 P24557 4/20 0.38
TBXA2R P21731 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
EEF2K O00418 1/20 0.37
MAPK1 P28482 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CCR9 P51686 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL8418074 0.97 UTS2R (0.41) UTS2RTBXAS1TBXA2RALDH1A1MEN1
SCHEMBL8417479 0.97 UTS2R (0.42) UTS2RTBXAS1TBXA2RALDH1A1MEN1
SCHEMBL8418094 0.95 UTS2R (0.41) UTS2RTBXAS1TBXA2RALDH1A1MEN1
SCHEMBL8417431 0.92 EEF2K (0.37) ALDH1A1EEF2KCYP1A2CYP2C19NPSR1
SCHEMBL8419454 0.92 UTS2R (0.44) UTS2RTBXAS1TBXA2RALDH1A1MEN1
SCHEMBL8421571 0.90 UTS2R (0.42) UTS2RTBXAS1TBXA2RALDH1A1MEN1
SCHEMBL8417508 0.90 TBXAS1 (0.45) UTS2RTBXAS1TBXA2RALDH1A1EEF2K
SCHEMBL8419466 0.89 EEF2K (0.37) ALDH1A1EEF2KCYP1A2CYP2C19NPSR1
SCHEMBL8418072 0.89 SIGMAR1 (0.39) ALDH1A1EEF2KCYP1A2CYP2C19NPSR1
SCHEMBL8417486 0.89 UTS2R (0.43) UTS2RTBXAS1TBXA2RALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0943606-A1 BENZENESULFONAMIDE DERIVATIVES AND DRUGS CONTAINING THE SAME HOKURIKU SEIYAKU CO., LTD. (JP) 1999-09-22 EP disclosed