SCHEMBL4734233

SCHEMBL4734233

Cc1cc(-c2ccccc2)nc2cc(C(=O)Nc3ccc4c(c3)OCO4)nn12

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.75
ALDH1A1 P00352 6/20 0.75
RAB9A P51151 3/20 0.75
SMN1; SMN2 Q16637 2/20 0.75
NPC1 O15118 1/20 0.75
TP53 P04637 5/20 0.71
LMNA P02545 2/20 0.67
POLB P06746 4/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
KDM4E B2RXH2 6/20 0.58
HSD17B10 Q99714 5/20 0.58
HPGD P15428 3/20 0.58
MAPK1 P28482 1/20 0.56
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
TSHR P16473 1/20 0.55
USP2 O75604 1/20 0.55
NR4A1 P22736 1/20 0.54

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
SCHEMBL3784675 0.86 RAB9A (1.00) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL4737183 0.84 TP53 (0.80) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL8202423 0.83 TP53 (0.77) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL1718453 0.81 HPGD (0.80) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL8191835 0.81 TP53 (0.77) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL8199380 0.80 MAPT (1.00) MAPTALDH1A1SMN1; SMN2TP53LMNA
SCHEMBL1718398 0.78 MAPT (0.75) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL1718691 0.77 TP53 (0.68) MAPTALDH1A1SMN1; SMN2TP53LMNA
SCHEMBL8192027 0.77 TP53 (0.65) MAPTALDH1A1RAB9ASMN1; SMN2TP53
SCHEMBL1718971 0.76 TP53 (0.68) MAPTALDH1A1RAB9ASMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008056176-A1 PYRAZOLOPYRIMIDINES AS PHOSPHODIESTERASE INHIBITORS SCOTTISH BIOMEDICAL LIMITED (GB) 2008-05-15 WO disclosed
WO-2008056176-A1 PYRAZOLOPYRIMIDINES AS PHOSPHODIESTERASE INHIBITORS SCOTTISH BIOMEDICAL LIMITED (GB) 2008-05-15 WO disclosed