SCHEMBL7537977

SCHEMBL7537977

Cc1cccc(N)c1C.O=C(O)c1sccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.52
HPGD P15428 2/20 0.46
TSHR P16473 2/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 3/20 0.45
ALDH1A1 P00352 2/20 0.45
HTT P42858 1/20 0.45
METAP2 P50579 3/20 0.43
NPSR1 Q6W5P4 2/20 0.42
ALOX15 P16050 2/20 0.42
KMT2A Q03164 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 1/20 0.42
MCL1 Q07820 1/20 0.41
TP53 P04637 1/20 0.41
NRP1 O14786 1/20 0.40

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
SCHEMBL7537970 0.87 ACLY (0.50) ACLYHPGDTSHRLMNAGAA
SCHEMBL532975 0.84 ACLY (0.69) ACLYHPGDTSHRLMNAGAA
Hydrochloric Acid SCHEMBL533067 0.83 ACLY (0.68) ACLYHPGDTSHRLMNAGAA
SCHEMBL7531860 0.82 LMNA (0.54) ACLYHPGDTSHRLMNAALDH1A1
SCHEMBL4569871 0.81 ACLY (0.52) ACLYTSHRKMT2AHSD17B10MEN1
SCHEMBL7538874 0.81 METAP2 (0.55) ACLYHPGDTSHRLMNAGAA
SCHEMBL7537973 0.81 LMNA (0.46) ACLYHPGDTSHRLMNAGAA
SCHEMBL2747710 0.81 ACLY (0.59) ACLYHPGDTSHRLMNANPSR1
SCHEMBL7530812 0.79 CYP2C9 (0.52) ACLYHPGDTSHRLMNAGAA
SCHEMBL2748413 0.79 ACLY (0.54) ACLYHPGDTSHRALDH1A1NPSR1

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