SCHEMBL7537211

SCHEMBL7537211

CC(=O)c1cccc(NC(=O)c2sccc2NS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.55
MEN1 O00255 5/20 0.55
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
PHGDH O43175 2/20 0.53
PKM P14618 1/20 0.52
NPSR1 Q6W5P4 1/20 0.49
HPGD P15428 1/20 0.48
POLB P06746 1/20 0.48
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
ALDH1A1 P00352 2/20 0.47
EGFR P00533 1/20 0.47
FGFR1 P11362 1/20 0.47
KDR P35968 1/20 0.47
ACLY P53396 1/20 0.47
EDNRA P25101 1/20 0.47

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
SCHEMBL7533940 0.90 RAB9A (0.56) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL7533552 0.87 NR1H3 (0.57) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL7569195 0.86 MEN1 (0.49) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL7533623 0.85 ACLY (0.55) KMT2AMEN1NPSR1HPGDALDH1A1
SCHEMBL7532028 0.85 ADORA3 (0.53) KMT2AMEN1PHGDHCA12CA9
SCHEMBL7538859 0.83 ACLY (0.53) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL3972622 0.83 CASP3 (0.50) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL7534407 0.82 LMNA (0.56) KMT2AMEN1CASP3SENP8SENP7
SCHEMBL7537207 0.81 ACLY (0.53) KMT2AMEN1NPSR1HPGDPOLB
SCHEMBL7537213 0.81 ACLY (0.53) KMT2AMEN1NPSR1HPGDPOLB

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