SCHEMBL7096932

SCHEMBL7096932

CCCn1c(=Nc2ccc(Br)cc2)sc2ncccc2c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 5/20 0.44
MAPT P10636 3/20 0.38
HTT P42858 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.35
POLB P06746 2/20 0.35
PKM P14618 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ADORA2B P29275 1/20 0.35
HPGD P15428 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
KDM4E B2RXH2 3/20 0.35
TGM2 P21980 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL7096931 1.00 KAT2B (0.44) KAT2BMAPTHTTSMN1; SMN2POLB
SCHEMBL7099357 0.90 KAT2B (0.46) KAT2BMAPTHTTSMN1; SMN2POLB
SCHEMBL7099355 0.90 KAT2B (0.46) KAT2BMAPTHTTSMN1; SMN2POLB
SCHEMBL7102653 0.90 KAT2B (0.41) KAT2BMAPTHTTSMN1; SMN2POLB
SCHEMBL7102651 0.90 KAT2B (0.41) KAT2BMAPTHTTSMN1; SMN2POLB
SCHEMBL7098771 0.89 KAT2B (0.46) KAT2BMAPTHTTPOLBPKM
SCHEMBL7097076 0.89 KAT2B (0.46) KAT2BMAPTHTTPOLBPKM
SCHEMBL7097067 0.89 MAPT (0.38) KAT2BMAPTHTTSMN1; SMN2POLB
SCHEMBL7097069 0.89 MAPT (0.38) KAT2BMAPTHTTSMN1; SMN2POLB
SCHEMBL7095433 0.87 KAT2B (0.49) KAT2BMAPTSMN1; SMN2POLBPKM

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