SCHEMBL8623664

SCHEMBL8623664

CC1=NS(=O)(=O)c2cnccc2N1C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
POLB P06746 1/20 0.33
MARK3 P27448 1/20 0.32
MARK4 Q96L34 1/20 0.32
OPRL1 P41146 4/20 0.32
OPRM1 P35372 3/20 0.32
OPRK1 P41145 3/20 0.32
CACNA1B Q00975 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
GAA P10253 1/20 0.31
STAT3 P40763 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
RPS6KA5 O75582 1/20 0.31
HPGD P15428 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
SCHEMBL8625791 1.00 ALDH1A1 (0.33) ALDH1A1POLBMARK3MARK4OPRL1
SCHEMBL8562486 0.74 CYP3A4 (0.33) CA12CA1CA2CA9CA14
SCHEMBL8629913 0.71 CA12 (0.31) CA12CA1CA2CA9
SCHEMBL8623666 0.69 L3MBTL1 (0.35) ALDH1A1CA12CA1CA2CA9
SCHEMBL8624375 0.67 GRIA2 (0.56) ALDH1A1HPGDKDM4E
SCHEMBL8627047 0.67 GRIA2 (0.56) ALDH1A1HPGDKDM4E
SCHEMBL27383326 0.66 OPRL1 (0.39) ALDH1A1OPRL1OPRM1OPRK1
SCHEMBL8623456 0.63 KDM4E (0.35) ALDH1A1OPRL1OPRM1OPRK1CACNA1B
SCHEMBL8626885 0.62 KDM4C (0.33) ALDH1A1OPRL1CACNA1BRPS6KA5KDM4E
SCHEMBL27490066 0.61 CA12 (0.37) ALDH1A1POLBCA12CA1CA2

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
EP-0618209-B1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR (FR) 1998-12-23 EP disclosed
EP-0618209-A1 Pyridothiadiazines, processes for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1994-10-05 EP disclosed