SCHEMBL10650146

SCHEMBL10650146

Oc1ncn2ncc(-c3cccs3)c2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
RXFP1 Q9HBX9 1/20 0.38
CAMK2D Q13557 9/20 0.38
CHEK1 O14757 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
CCNA1 P78396 1/20 0.37
MET P08581 1/20 0.37
KCNH2 Q12809 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
MAPT P10636 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
RPS6KB2 Q9UBS0 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL4881184 0.72 PIM1 (0.39) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL9210120 0.70 MEN1 (0.47) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL4337278 0.67 PIM1 (0.49) MAPTGAAFYN
SCHEMBL4331345 0.64 CAMK2D (0.41) MEN1KMT2ACAMK2DKCNH2NFKB1
SCHEMBL8686454 0.63 PLAT (0.39) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL2345970 0.62 ALDH1A1 (0.69) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL20805585 0.62 NPC1 (0.44) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL14626213 0.62 RPS6KB2 (0.47) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL24147766 0.61 PIK3CA (0.46) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL25994206 0.61 MAPT (0.40) NPC1RAB9AMEN1KMT2AMET

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269859-A2 Pyrazolotriazine compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-06-08 EP disclosed