SCHEMBL4052733

SCHEMBL4052733

CNS(=O)(=O)c1cccc(C(=O)/C=C/N(C)C)c1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.57
ALDH1A1 P00352 5/20 0.57
HTT P42858 4/20 0.57
GAA P10253 3/20 0.57
HPGD P15428 2/20 0.57
SMN1; SMN2 Q16637 1/20 0.55
RECQL P46063 2/20 0.54
RAB9A P51151 2/20 0.52
LMNA P02545 3/20 0.48
PTBP1 P26599 1/20 0.48
TDP1 Q9NUW8 3/20 0.47
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
ALOX12 P18054 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL4052735 1.00 MAPT (0.57) MAPTALDH1A1HTTGAAHPGD
SCHEMBL4237644 0.83 ALDH1A1 (0.51) MAPTALDH1A1HTTGAAHPGD
SCHEMBL4237642 0.83 ALDH1A1 (0.51) MAPTALDH1A1HTTGAAHPGD
SCHEMBL4055382 0.83 ALDH1A1 (0.60) MAPTALDH1A1HTTGAAHPGD
SCHEMBL4055383 0.83 ALDH1A1 (0.60) MAPTALDH1A1HTTGAAHPGD
SCHEMBL4059271 0.82 CYP2C19 (0.54) MAPTALDH1A1HTTGAAHPGD
SCHEMBL4059267 0.82 CYP2C19 (0.54) MAPTALDH1A1HTTGAAHPGD
SCHEMBL4056415 0.81 CYP2C19 (0.50) MAPTALDH1A1HTTGAAHPGD
SCHEMBL4056421 0.81 CYP2C19 (0.50) MAPTALDH1A1HTTGAAHPGD
SCHEMBL5946453 0.80 MAPT (0.77) MAPTALDH1A1HTTGAAHPGD

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
WO-2009111260-A1 PHENYLSULFONAMIDE-SUBSTITUTED, PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF WYETH (US) 2009-09-11 WO disclosed