SCHEMBL8569581

SCHEMBL8569581

COC(=O)Nc1nc(CC(=O)O)ns1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.44
NPC1 O15118 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MAPT P10636 3/20 0.44
RAB9A P51151 2/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 3/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 3/20 0.40
HSD17B10 Q99714 2/20 0.40
MEN1 O00255 2/20 0.40
ALOX5 P09917 1/20 0.38
ALOX15 P16050 1/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL8573320 0.87 NPC1 (0.44) ALDH1A1NPC1SMN1; SMN2MAPTRAB9A
SCHEMBL6757740 0.86 ALDH1A1 (0.45) ALDH1A1NPC1SMN1; SMN2MAPTRAB9A
SCHEMBL1080488 0.85 ALDH1A1 (0.41) ALDH1A1NPC1SMN1; SMN2MAPTRAB9A
SCHEMBL8573205 0.83 ALDH1A1 (0.50) ALDH1A1NPC1SMN1; SMN2MAPTRAB9A
SCHEMBL8568524 0.82 TSHR (0.43) ALDH1A1NPC1SMN1; SMN2MAPTRAB9A
SCHEMBL8572623 0.80 ALDH1A1 (0.48) ALDH1A1NPC1SMN1; SMN2MAPTRAB9A
SCHEMBL9564494 0.80 ALDH1A1 (0.49) ALDH1A1NPC1SMN1; SMN2RAB9ALMNA
SCHEMBL8572006 0.79 NPC1 (0.37) ALDH1A1NPC1SMN1; SMN2MAPTRAB9A
SCHEMBL14647559 0.74 KDM4E (0.52) ALDH1A1NPC1SMN1; SMN2MAPTRAB9A
SCHEMBL8567632 0.74 TSHR (0.47) ALDH1A1NPC1SMN1; SMN2MAPTRAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5271210-A None JP disclosed
US-5705650-A Process for preparing 1,2,4-thiadiazole derivatives KATAYAMA SEIYAKUSYO CO., LTD. (JP) 1998-01-06 US disclosed
US-5585494-A Process for preparing 1,2,4-thiadiazole derivatives KATAYAMA SEIYAKUSYO CO. LTD. (JP) 1996-12-17 US disclosed
JP-H05271210-A PRODUCTION OF THIADIAZOLE COMPOUND KATAYAMA SEIYAKUSHIYO:KK 1993-10-19 JP disclosed
EP-0536900-A2 Process for preparing 1,2,4-Thiadiazole Derivatives KATAYAMA SEIYAKUSYO CO. Ltd. (JP) 1993-04-14 EP disclosed