SCHEMBL9219409

SCHEMBL9219409

COc1cc(-c2cnn3c(O)ncnc23)cc(OC)c1O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 6/20 0.41
MAPT P10636 2/20 0.40
FYN P06241 3/20 0.39
GAK O14976 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ERN1 O75460 2/20 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
SCHEMBL9221092 0.90 FYN (0.43) MAPTFYN
SCHEMBL9219353 0.86 MAPT (0.56) MAPTFYNGAKMEN1NPC1
SCHEMBL9215969 0.84 CYP1A1 (0.42) MAPTMEN1NPC1RAB9AKMT2A
SCHEMBL9220988 0.84 MAPT (0.45) MAPTFYNGAKMEN1NPC1
SCHEMBL9218703 0.82 MAPT (0.48) MAPTFYNGAKMEN1NPC1
SCHEMBL9215050 0.81 MAPT (0.43) MAPTFYNGAKMEN1NPC1
SCHEMBL9221145 0.80 CYP17A1 (0.36) MAPTMEN1NPC1RAB9AKMT2A
SCHEMBL9219419 0.80 ALDH1A1 (0.34) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL9218344 0.80 MAPT (0.41) SMPD3MAPTFYNGAKMEN1
SCHEMBL9217924 0.79 KMT2A (0.54) MAPTMEN1NPC1RAB9AKMT2A

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-0269859-B2 Pyrazolotriazine compounds OTSUKA PHARMA CO LTD (JP) 1995-10-18 EP disclosed
US-4824834-A TREATING GOUT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-04-25 US disclosed
EP-0269859-A2 Pyrazolotriazine compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-06-08 EP disclosed