SCHEMBL7568445

SCHEMBL7568445

O=C(Nc1ccc(F)cc1)c1sccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.53
KMT2A Q03164 6/20 0.53
ALDH1A1 P00352 3/20 0.52
KDM4E B2RXH2 2/20 0.52
USP2 O75604 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 4/20 0.50
AVPR2 P30518 1/20 0.50
GPR27 Q9NS67 1/20 0.50
STING1 Q86WV6 1/20 0.50
HTT P42858 1/20 0.50
ABCB1 P08183 2/20 0.49
FLT1 P17948 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
GRM4 Q14833 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL7533361 0.89 ACLY (0.48) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL7531331 0.89 DHODH (0.55) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL7539025 0.88 MEN1 (0.62) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL7537204 0.87 MAPT (0.51) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL7539041 0.87 MEN1 (0.53) MEN1KMT2AALDH1A1AVPR2GPR27
SCHEMBL7531704 0.85 ALDH1A1 (0.57) MEN1KMT2AALDH1A1USP2MAPT
SCHEMBL7530740 0.85 MEN1 (0.50) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL7534407 0.83 LMNA (0.56) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL7533710 0.83 CYP3A4 (0.70) MEN1KMT2AALDH1A1KDM4ETDP1
SCHEMBL7533715 0.83 LMNA (0.52) MEN1KMT2AALDH1A1KDM4ETDP1

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-2002028353-A2 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-11 WO disclosed