SCHEMBL14395366

SCHEMBL14395366

CCC[C@H](C)CCCn1nc(C)c(NC(=O)c2ccccc2OC)c1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.42
ALDH1A1 P00352 5/20 0.41
MAPT P10636 5/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
CTSD P07339 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
TP53 P04637 2/20 0.39
MAPK1 P28482 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TSHR P16473 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 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
SCHEMBL5233570 0.71 KMT2A (0.47) MAPTMEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL988 0.71 MAPT (0.50) TERTALDH1A1MAPTMEN1LMNA
SCHEMBL5233620 0.71 KMT2A (0.48) ALDH1A1MAPTMEN1LMNAKMT2A
SCHEMBL5233613 0.71 KMT2A (0.48) ALDH1A1MAPTMEN1LMNAKMT2A
SCHEMBL5236948 0.71 KMT2A (0.48) ALDH1A1MAPTMEN1LMNAKMT2A
SCHEMBL7003270 0.67 TERT (0.48) TERTALDH1A1MAPTMEN1LMNA
SCHEMBL3670031 0.67 TERT (0.63) TERTMAPTLMNAL3MBTL1SMN1; SMN2
SCHEMBL742 0.66 TERT (0.51) TERTALDH1A1MAPTMEN1LMNA
SCHEMBL5233782 0.65 USP2 (0.48) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL12462401 0.65 ALDH1A1 (0.46) TERTALDH1A1MAPTMEN1LMNA

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-1454897-B1 PYRAZOLOPYRIMIDINONE DERIVATIVES HAVING PDE7-INHIBITORY ACTIVITY ASUBIO PHARMA CO LTD (JP) 2007-10-10 EP disclosed