SCHEMBL1289370

SCHEMBL1289370

CNC(CCN)c1nc(-c2cc3ccccc3o2)nc2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.38
PRMT7 Q9NVM4 1/20 0.38
PDE10A Q9Y233 1/20 0.37
TACR3 P29371 1/20 0.37
MAPT P10636 5/20 0.36
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
HPGD P15428 3/20 0.36
HSD17B10 Q99714 2/20 0.36
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
STAT1 P42224 1/20 0.34
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
THRB P10828 1/20 0.34
USP2 O75604 1/20 0.34
MAPK10 P53779 1/20 0.34
F2RL3 Q96RI0 2/20 0.34
CD74 P04233 1/20 0.34

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
Hydrochloric Acid SCHEMBL4512403 0.86 PDE10A (0.38) SIRT6PRMT7PDE10ATACR3MAPT
SCHEMBL12473398 0.83 PDE10A (0.37) SIRT6PRMT7PDE10ATACR3MAPT
SCHEMBL12473432 0.81 PDE10A (0.36) SIRT6PRMT7PDE10ATACR3MAPT
Hydrochloric Acid SCHEMBL4512248 0.80 PDE10A (0.41) SIRT6PDE10ATACR3MAPTALDH1A1
SCHEMBL12473409 0.79 PDE10A (0.35) SIRT6PRMT7PDE10ATACR3MAPT
SCHEMBL12473350 0.78 PDE10A (0.39) SIRT6PDE10ATACR3MAPTALDH1A1
SCHEMBL12473359 0.77 SIRT6 (0.36) SIRT6PRMT7PDE10ATACR3MAPT
Hydrochloric Acid SCHEMBL4493037 0.76 PDE10A (0.38) SIRT6PRMT7PDE10ATACR3MAPT
SCHEMBL1289380 0.73 MKNK1 (0.40) SIRT6PDE10ATACR3MAPTALDH1A1
SCHEMBL12473319 0.73 PRMT7 (0.35) PRMT7MAPTALDH1A1KDM4ESMN1; SMN2

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-2012046207-A1 ANTI-PARASITIC SUBSTITUTED RING FUSED AZINE COMPOUNDS PARACO TECHNOLOGY LIMITED (NZ) 2012-04-12 WO disclosed