SCHEMBL7099733

SCHEMBL7099733

Cn1c(=Nc2ccccc2)sc2ncccc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 9/20 0.46
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
ALDH1A1 P00352 2/20 0.38
LIPG Q9Y5X9 1/20 0.38
EP300 Q09472 2/20 0.37
CREBBP Q92793 2/20 0.37
KAT2A Q92830 2/20 0.37
FEN1 P39748 1/20 0.37
NPC1 O15118 1/20 0.36
NSD2 O96028 1/20 0.36
RAB9A P51151 1/20 0.36
MCL1 Q07820 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TP53 P04637 1/20 0.36
PDE4D Q08499 1/20 0.36

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
SCHEMBL7099729 1.00 KAT2B (0.46) KAT2BMAPTGAAKDM4EMAPK1
SCHEMBL7099117 0.90 KAT2B (0.50) KAT2BMAPTKDM4EHTTALDH1A1
SCHEMBL7099114 0.90 KAT2B (0.50) KAT2BMAPTKDM4EHTTALDH1A1
SCHEMBL7096481 0.88 KAT2B (0.49) KAT2BMAPTGAAKDM4EEP300
SCHEMBL7096926 0.88 KAT2B (0.49) KAT2BMAPTALDH1A1EP300CREBBP
SCHEMBL7099839 0.88 KAT2B (0.38) KAT2BMAPTGAAALDH1A1EP300
SCHEMBL7096479 0.88 KAT2B (0.49) KAT2BMAPTGAAKDM4EEP300
SCHEMBL7096924 0.88 KAT2B (0.49) KAT2BMAPTALDH1A1EP300CREBBP
SCHEMBL7096876 0.88 GSK3B (0.42) KAT2BMAPTKDM4EMAPK1HTT
SCHEMBL7099838 0.88 KAT2B (0.38) KAT2BMAPTGAAALDH1A1EP300

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-0878196-B1 KAINIC ACID NEURONOTOXICITY INHIBITORS AND PYRIDOTHIAZINE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2003-09-03 EP disclosed
US-6133258-A PYRIDOTHIAZINE DERIVATIVE; FOR TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS, MULTIPLE SCLEROSIS, PAIN, GLAUCOMA YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2000-10-17 US disclosed
EP-0878196-A1 KAINIC ACID NEURONOTOXICITY INHIBITORS AND PYRIDOTHIAZINE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1998-11-18 EP disclosed