SCHEMBL4783407

SCHEMBL4783407

Cc1occc1-c1nnn[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HPGD P15428 3/20 0.38
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 5/20 0.35
NPC1 O15118 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
HTT P42858 1/20 0.35
GFER P55789 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
TSHR P16473 2/20 0.34
KDM4E B2RXH2 2/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 1/20 0.33
HSP90AA1 P07900 1/20 0.33
RAB9A P51151 3/20 0.32

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
SCHEMBL4783402 0.78
SCHEMBL4784479 0.74 NQO1 (0.33)
SCHEMBL9826439 0.71
SCHEMBL9176591 0.69 CALM1 (0.31) HPGDSMN1; SMN2NPC1L3MBTL1TSHR
SCHEMBL918324 0.69 DCUN1D1 (0.47) GAAHPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL14440820 0.68 POLB (0.34) POLBHSP90AA1
SCHEMBL8987547 0.67 HPGD (0.42) GAATDP1HPGDALDH1A1SMN1; SMN2
SCHEMBL4783020 0.67 PLA2G10 (0.42)
SCHEMBL4784476 0.67
SCHEMBL3394704 0.66 ALDH1A1 (0.53) GAAHPGDALDH1A1MEN1KMT2A

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-2008031888-A2 CONDENSED PYRIMIDINONES ACTIVE ON GLUTAMATERGIC RECEPTORS CAMPIANI GIUSEPPE (IT) 2008-03-20 WO claimed
WO-2008031888-A2 CONDENSED PYRIMIDINONES ACTIVE ON GLUTAMATERGIC RECEPTORS CAMPIANI GIUSEPPE (IT) 2008-03-20 WO disclosed