SCHEMBL9219561

SCHEMBL9219561

Oc1ncnc2c(-c3ccc(Cl)cc3)cnn12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.52
NPC1 O15118 9/20 0.52
MAPT P10636 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
RXFP1 Q9HBX9 2/20 0.52
ALDH1A1 P00352 7/20 0.52
KDM4E B2RXH2 4/20 0.52
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
POLB P06746 3/20 0.47
LMNA P02545 2/20 0.47
HPGD P15428 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GPR119 Q8TDV5 4/20 0.44
KDR P35968 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42

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
SCHEMBL8993213 0.92 RAB9A (0.46) RAB9ANPC1MAPTSMN1; SMN2RXFP1
SCHEMBL9215756 0.87 SRC (0.45) RAB9ANPC1MAPTSMN1; SMN2RXFP1
SCHEMBL9220305 0.84 RAB9A (0.43) RAB9ANPC1MAPTSMN1; SMN2RXFP1
SCHEMBL9213350 0.84 RAB9A (0.52) RAB9ANPC1MAPTSMN1; SMN2RXFP1
SCHEMBL9219923 0.84 DGAT1 (0.39) RAB9ANPC1MAPTSMN1; SMN2RXFP1
SCHEMBL9221670 0.84 RAB9A (0.45) RAB9ANPC1MAPTSMN1; SMN2RXFP1
SCHEMBL9218594 0.84 RAB9A (0.40) RAB9ANPC1MAPTSMN1; SMN2RXFP1
SCHEMBL9172768 0.84 RAB9A (0.55) RAB9ANPC1MAPTSMN1; SMN2RXFP1
SCHEMBL9215740 0.84 KMO (0.41) RAB9ANPC1MAPTSMN1; SMN2RXFP1
SCHEMBL9219528 0.83 CES1 (0.48) RAB9ANPC1MAPTSMN1; SMN2RXFP1

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