SCHEMBL7096515

SCHEMBL7096515

CCCCn1c(=O)c2cccnc2s/c1=N\c1ccc(C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
PGR P06401 2/20 0.45
RORA P35398 2/20 0.45
RORC P51449 2/20 0.45
RORB Q92753 2/20 0.45
HTT P42858 1/20 0.44
KAT2B Q92831 3/20 0.44
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
CNR2 P34972 2/20 0.38

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
SCHEMBL7096516 1.00 MAPT (0.47) MAPTPGRRORARORCRORB
SCHEMBL7099357 0.93 KAT2B (0.46) MAPTPGRRORARORCRORB
SCHEMBL7099355 0.93 KAT2B (0.46) MAPTPGRRORARORCRORB
SCHEMBL7099626 0.91 MAPT (0.49) MAPTPGRRORARORCRORB
SCHEMBL7099625 0.91 MAPT (0.49) MAPTPGRRORARORCRORB
SCHEMBL7099943 0.89 KAT2B (0.47) MAPTHTTKAT2BTDP1L3MBTL1
SCHEMBL7099940 0.89 KAT2B (0.47) MAPTHTTKAT2BTDP1L3MBTL1
SCHEMBL7096406 0.89 KAT2B (0.47) MAPTHTTKAT2BPDE4APDE4B
SCHEMBL7096404 0.89 KAT2B (0.47) MAPTHTTKAT2BPDE4APDE4B
Hydrochloric Acid SCHEMBL7099337 0.85 KDM4E (0.49) KAT2BKMT2APOLBNPC1LMNA

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