SCHEMBL8558650

SCHEMBL8558650

Nc1ccncc1S(=O)(=O)NC1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.49
MCOLN3 Q8TDD5 2/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
KDM4E B2RXH2 1/20 0.47
RECQL P46063 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HTT P42858 2/20 0.45
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
BRD4 O60885 1/20 0.44
BRS3 P32247 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
HPGD P15428 1/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43

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
SCHEMBL8562445 0.82 ALDH1A1 (0.61) ALDH1A1MCOLN3LMNASMN1; SMN2KDM4E
SCHEMBL11228520 0.78 ALDH1A1 (0.64) ALDH1A1MCOLN3LMNASMN1; SMN2KDM4E
SCHEMBL12481671 0.76 ALDH1A1 (0.66) ALDH1A1MCOLN3LMNASMN1; SMN2KDM4E
SCHEMBL9259585 0.76 BRS3 (0.45) ALDH1A1LMNASMN1; SMN2MAPTNPSR1
SCHEMBL4352952 0.73 ALDH1A1 (0.48) ALDH1A1MCOLN3LMNASMN1; SMN2KDM4E
SCHEMBL15333501 0.73 ALDH1A1 (0.61) ALDH1A1MCOLN3LMNASMN1; SMN2KDM4E
SCHEMBL15225912 0.73 SMN1; SMN2 (0.59) ALDH1A1MCOLN3LMNASMN1; SMN2KDM4E
SCHEMBL6618815 0.73 CA12 (0.47) ALDH1A1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL8560216 0.72 CA12 (0.41) ALDH1A1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL29498544 0.71 ALDH1A1 (0.52) ALDH1A1MCOLN3LMNAMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618209-B1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1998-12-23 EP disclosed
US-5459138-A Dysfunctions of glutamatergic neurotransmission associated with learning and memory ADIR ET COMPAGNIE (FR) 1995-10-17 US disclosed
EP-0618209-A1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1994-10-05 EP disclosed