SCHEMBL8562445

SCHEMBL8562445

O=S(=O)(NC1CCCCC1)c1cnccc1Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
MCOLN3 Q8TDD5 3/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 3/20 0.48
HPGD P15428 2/20 0.48
GAA P10253 2/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
RECQL P46063 1/20 0.47
MAPT P10636 1/20 0.47
TSHR P16473 2/20 0.45
HSD17B10 Q99714 1/20 0.45
TP53 P04637 1/20 0.45
PKM P14618 1/20 0.45
ALOX15 P16050 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
BRS3 P32247 1/20 0.44
BRD4 O60885 1/20 0.44

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
SCHEMBL8558650 0.82 ALDH1A1 (0.49) ALDH1A1L3MBTL1MCOLN3LMNAHTT
SCHEMBL28820135 0.78 ALDH1A1 (0.97) ALDH1A1L3MBTL1MCOLN3LMNAHTT
SCHEMBL2875807 0.73 ALDH1A1 (0.61) ALDH1A1L3MBTL1MCOLN3LMNAHTT
SCHEMBL15225912 0.73 SMN1; SMN2 (0.59) ALDH1A1MCOLN3LMNAHTTHPGD
SCHEMBL8212413 0.73 LMNA (0.49) ALDH1A1LMNAHTTKMT2ASMN1; SMN2
SCHEMBL7908992 0.72 GSTO1 (0.45) ALDH1A1LMNAKMT2ASMN1; SMN2KDM4E
SCHEMBL10455310 0.72 ALDH1A1 (0.67) ALDH1A1L3MBTL1MCOLN3LMNAHTT
SCHEMBL10453953 0.71 ALDH1A1 (0.77) ALDH1A1L3MBTL1MCOLN3LMNAHTT
SCHEMBL4000366 0.71 ALDH1A1 (0.70) ALDH1A1L3MBTL1MCOLN3LMNAHTT
SCHEMBL5504038 0.71 ALDH1A1 (0.61) ALDH1A1L3MBTL1MCOLN3LMNAHTT

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