SCHEMBL7530799

SCHEMBL7530799

NC1CCCCC1(N)S(=O)(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
SLC22A12 Q96S37 8/20 0.38
GAA P10253 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CHRM4 P08173 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HDAC4 P56524 1/20 0.35
CYP2C9 P11712 1/20 0.34
SLC22A6 Q4U2R8 1/20 0.34
SLC22A8 Q8TCC7 1/20 0.34
SLC22A11 Q9NSA0 1/20 0.34
NPY1R P25929 2/20 0.34
NPY5R Q15761 2/20 0.34
HCRTR1 O43613 1/20 0.34
KAT6A Q92794 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL4775447 0.80 HTR2A (0.38) MEN1KMT2AGAAALDH1A1
SCHEMBL2949828 0.76 GAA (0.51) MEN1KMT2AGAAALDH1A1
SCHEMBL5059654 0.75 KMT2A (0.50) MEN1KMT2AALDH1A1
SCHEMBL28166430 0.69 MEN1 (0.51) MEN1KMT2ASLC22A12GAATDP1
SCHEMBL7529372 0.69
SCHEMBL4775445 0.68 SMN1; SMN2 (0.54) KMT2AGAAALDH1A1CYP2C9
SCHEMBL3808068 0.66 SFRP1 (0.49) MEN1KMT2ASLC22A12ALDH1A1CYP2C9
SCHEMBL28053508 0.66 CA1 (0.32)
SCHEMBL29418255 0.64 MEN1 (0.56) MEN1KMT2ASLC22A12ALDH1A1CYP2C9
SCHEMBL302570 0.64 MEN1 (0.56) MEN1KMT2ASLC22A12ALDH1A1CYP2C9

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
EP-1185488-A1 SULPHONYLAMIDES AND CARBOXAMIDES AND THEIR USE IN ASYMMETRICAL CATALYSIS RHODIA CHIMIE (FR) 2002-03-13 EP claimed
WO-2000076942-A1 SULPHONYLAMIDES AND CARBOXAMIDES AND THEIR USE IN ASYMMETRICAL CATALYSIS RHODIA CHIMIE (FR) 2000-12-21 WO claimed