SCHEMBL362659

SCHEMBL362659

C=C(NS(=O)(=O)c1ccc2c(c1)CC(Nc1ncc(C(F)(F)F)cc1Cl)C2)S/C(=N\C)C1CC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 7/20 0.35
GAA P10253 6/20 0.35
HTT P42858 3/20 0.35
POLB P06746 3/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 4/20 0.35
NPSR1 Q6W5P4 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HCRTR1 O43613 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AHR P35869 1/20 0.33
HCRTR2 O43614 1/20 0.33

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
SCHEMBL2772880 0.77 MEN1 (0.48) MEN1KMT2ATDP1ALDH1A1GAA
SCHEMBL294734 0.71 MEN1 (0.50) MEN1KMT2ATDP1ALDH1A1HTT
SCHEMBL293567 0.71 KMT2A (0.45) MEN1KMT2ATDP1ALDH1A1HTT
SCHEMBL295358 0.70 MEN1 (0.46) MEN1KMT2ATDP1ALDH1A1HTT
SCHEMBL294156 0.69 KMT2A (0.49) MEN1KMT2ATDP1ALDH1A1HTT
SCHEMBL295244 0.69 KMT2A (0.47) MEN1KMT2ATDP1ALDH1A1HTT
SCHEMBL2776092 0.68 POLB (0.49) MEN1KMT2ATDP1ALDH1A1GAA
SCHEMBL2772039 0.68 MEN1 (0.46) MEN1KMT2ATDP1ALDH1A1GAA
SCHEMBL2776020 0.66 KDM4E (0.46) MEN1KMT2ATDP1ALDH1A1GAA
SCHEMBL295977 0.65 ALDH1A1 (0.45) MEN1KMT2ATDP1ALDH1A1GAA

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-2240474-B1 CYCLIC PYRIDYL-N-(1,3,4)-THIADIAZOL-2-YL-BENZENE SULFONAMIDES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2012-03-14 EP disclosed