SCHEMBL7539012

SCHEMBL7539012

CCCCOc1ccc(C(N)=O)cc1.O=C(O)c1sccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
TSHR P16473 3/20 0.47
HPGD P15428 1/20 0.47
KAT6A Q92794 1/20 0.47
ACLY P53396 1/20 0.46
PARP10 Q53GL7 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HTT P42858 1/20 0.45
POLB P06746 2/20 0.45
MCL1 Q07820 1/20 0.43
BCL2A1 Q16548 1/20 0.43
S1PR3 Q99500 1/20 0.43
WDR5 P61964 1/20 0.43
METAP2 P50579 1/20 0.42
TP53 P04637 2/20 0.42
MAPT P10636 1/20 0.42
CACNA1H O95180 1/20 0.42
CACNA1B Q00975 1/20 0.42
PLK1 P53350 1/20 0.41
SLC16A3 O15427 1/20 0.41

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
SCHEMBL7537343 0.97 S1PR3 (0.47) LMNATSHRHPGDKAT6AACLY
SCHEMBL7539018 0.90 LMNA (0.49) LMNATSHRHPGDKAT6AACLY
SCHEMBL7537356 0.87 LMNA (0.47) LMNATSHRHPGDKAT6AACLY
SCHEMBL7533711 0.84 LMNA (0.49) LMNATSHRHPGDKAT6AACLY
SCHEMBL7539015 0.82 LMNA (0.55) LMNATSHRHPGDKAT6ASMN1; SMN2
SCHEMBL7537995 0.82 ACLY (0.56) LMNATSHRHPGDACLYPARP10
SCHEMBL7537349 0.80 LMNA (0.53) LMNATSHRHPGDKAT6ASMN1; SMN2
SCHEMBL7533705 0.79 SCN3A (0.56) LMNATSHRACLYSMN1; SMN2HTT
SCHEMBL532975 0.78 ACLY (0.69) LMNATSHRHPGDACLYHTT
Hydrochloric Acid SCHEMBL533067 0.77 ACLY (0.68) LMNATSHRHPGDACLYHTT

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