SCHEMBL7905729

SCHEMBL7905729

Cc1n[nH]c2nc3ccccc3c(N3CCCCC3)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.51
L3MBTL1 Q9Y468 6/20 0.47
KDM4E B2RXH2 5/20 0.47
GAA P10253 3/20 0.47
NCF1 P14598 2/20 0.47
ACHE P22303 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HPGD P15428 3/20 0.44
LMNA P02545 1/20 0.44
ATM Q13315 2/20 0.43
MAPK1 P28482 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
ELANE P08246 1/20 0.43
GLA P06280 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 2/20 0.42
POLB P06746 1/20 0.42
ALOX12 P18054 1/20 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
SCHEMBL10863962 0.75 L3MBTL1 (0.61) L3MBTL1KDM4EGAANCF1ACHE
SCHEMBL27616510 0.74 CYP1A2 (0.56) PDE10AL3MBTL1KDM4EGAANCF1
SCHEMBL9006212 0.73 MAOA (0.48) KDM4EHPGDELANETSHRHSD17B10
SCHEMBL7828268 0.70 PDE10A (0.56) PDE10AGAAMEN1KMT2ALMNA
SCHEMBL10855624 0.70 TERT (0.56) L3MBTL1KDM4EGAANCF1ACHE
SCHEMBL14393692 0.68 L3MBTL1 (0.69) L3MBTL1KDM4EGAANCF1ACHE
SCHEMBL7031171 0.66 IGF1R (0.62)
SCHEMBL2384919 0.66 ALDH1A1 (0.51) PDE10AL3MBTL1KDM4EGAANCF1
SCHEMBL31663100 0.65 KMT2A (0.97) L3MBTL1KDM4EGAANCF1MEN1
SCHEMBL14975993 0.64 KDM4E (1.00) L3MBTL1KDM4EGAANCF1ACHE

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
WO-2010062559-A1 SUBSTITUTED PYRAZOLOQUINOLINES AND DERIVATIVES THEREOF SCHERING CORPORATION (US) 2010-06-03 WO disclosed