SCHEMBL8623915

SCHEMBL8623915

O=S1(=O)c2cnccc2NCN1c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.36
FFAR4 Q5NUL3 5/20 0.35
FFAR1 O14842 1/20 0.35
ALDH1A1 P00352 1/20 0.35
FGFR1 P11362 1/20 0.35
NAMPT P43490 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
SLC40A1 Q9NP59 1/20 0.32
MAPT P10636 4/20 0.31
HTT P42858 2/20 0.31
MAPK1 P28482 1/20 0.31
CYP3A4 P08684 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL8631587 0.75 CA7 (0.43) CA12CA1CA2CA9MAPT
SCHEMBL8628232 0.72 MMP9 (0.38) CYP3A4
SCHEMBL8627050 0.70 GRIA2 (0.38) ALDH1A1FGFR1NAMPTCA12CA1
SCHEMBL8626885 0.69 KDM4C (0.33) ALDH1A1NAMPTKDM4EMEN1KMT2A
SCHEMBL8625943 0.67 GAA (0.35) CA12CA9MAPTNPSR1GAA
SCHEMBL8623459 0.66 NPC1 (0.36) FFAR4FFAR1ALDH1A1FGFR1CA12
SCHEMBL8623987 0.63 CA12 (0.40) ALDH1A1NAMPTCA12CA1CA2
SCHEMBL6618431 0.61 NAMPT (0.32) NAMPTCA2CA9GAA
SCHEMBL8557791 0.61 GRIA1 (0.34)
SCHEMBL4064417 0.61 CA12 (0.37) PTPN1ALDH1A1FGFR1NAMPTCA12

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