SCHEMBL8631741

SCHEMBL8631741

NC1=NS(=O)(=O)c2cnccc2N1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 1/20 0.36
ALDH1A1 P00352 2/20 0.34
THRB P10828 2/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34
ABCC8 Q09428 1/20 0.34
KCNJ11 Q14654 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NAMPT P43490 1/20 0.33
EGFR P00533 1/20 0.32
ERBB2 P04626 1/20 0.32
MAPT P10636 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31

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
SCHEMBL8286622 0.79 CA12 (0.62) CA12CA1CA2CA9CA14
SCHEMBL6617228 0.79 CA12 (0.36) CA12CA1CA2CA9CA14
Water SCHEMBL27490788 0.78 CA12 (0.37) CA12CA1CA2CA9CA14
SCHEMBL8623946 0.76 CA12 (0.38) CA12CA1CA2CA9CA14
SCHEMBL14077410 0.76 CA12 (0.38) CA12CA1CA2CA9CA14
SCHEMBL8624743 0.76 CA12 (0.38) CA12CA1CA2CA9CA14
SCHEMBL8627414 0.76 ALDH1A1 (0.39) CA12CA1CA2CA9CA14
SCHEMBL6621056 0.74 CA12 (0.38) CA12CA1CA2CA9CA14
Water SCHEMBL6617511 0.74 CA12 (0.37) CA12CA1CA2CA9CA14
SCHEMBL2364650 0.72 CA12 (0.42) CA12CA1CA2CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1208418-A Pyrido-1, 2, 4-thiadiazine and pyrido-1, 4-thiazine derivatives, preparation method and application thereof NOVO NORDISK AS (DK) 1999-02-17 CN disclosed
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