SCHEMBL7102653

SCHEMBL7102653

CCCn1c(=Nc2ccccc2)sc2ncccc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 4/20 0.41
MAPT P10636 2/20 0.40
LIPG Q9Y5X9 2/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 2/20 0.40
PDE4A P27815 3/20 0.39
PDE4B Q07343 3/20 0.39
PDE4C Q08493 3/20 0.39
PDE4D Q08499 3/20 0.39
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 2/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TGM2 P21980 1/20 0.36
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
TP53 P04637 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
SCHEMBL7102651 1.00 KAT2B (0.41) KAT2BMAPTLIPGHTTALDH1A1
SCHEMBL7099626 0.93 MAPT (0.49) KAT2BMAPTHTTALDH1A1PDE4A
SCHEMBL7099625 0.93 MAPT (0.49) KAT2BMAPTHTTALDH1A1PDE4A
SCHEMBL7099355 0.91 KAT2B (0.46) KAT2BMAPTLIPGHTTALDH1A1
SCHEMBL7099357 0.91 KAT2B (0.46) KAT2BMAPTLIPGHTTALDH1A1
SCHEMBL7096641 0.90 KAT2B (0.43) KAT2BMAPTLIPGALDH1A1PDE4A
SCHEMBL7096644 0.90 KAT2B (0.43) KAT2BMAPTLIPGALDH1A1PDE4A
SCHEMBL7097076 0.90 KAT2B (0.46) KAT2BMAPTHTTALDH1A1PDE4D
SCHEMBL7097069 0.90 MAPT (0.38) KAT2BMAPTHTTALDH1A1PDE4A
SCHEMBL7096931 0.90 KAT2B (0.44) KAT2BMAPTHTTALDH1A1PDE4A

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