SCHEMBL7516038

SCHEMBL7516038

O=c1[nH]nnc2nn(Cc3ccccc3Cl)cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TYR P14679 1/20 0.43
AR P10275 1/20 0.42
ROCK2 O75116 1/20 0.40
PIM1 P11309 1/20 0.40
GSK3B P49841 1/20 0.40
AURKB Q96GD4 1/20 0.40
ATM Q13315 2/20 0.40
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
CYP19A1 P11511 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
TRPC5 Q9UL62 1/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
POLB P06746 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL7514619 0.85 AR (0.42) ARROCK2PIM1GSK3BAURKB
SCHEMBL7510407 0.84 ADORA3 (0.51) TDP1ARCYP19A1L3MBTL1ADORA3
SCHEMBL7513782 0.81 AR (0.45) TDP1ARATMMEN1KMT2A
SCHEMBL7509548 0.81 KMT2A (0.44) LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL7511491 0.80 LMNA (0.39) LMNAROCK2PIM1GSK3BAURKB
SCHEMBL7482606 0.80 MEN1 (0.56) LMNATDP1TYRROCK2PIM1
SCHEMBL7509410 0.78 TYR (0.44) TYRROCK2GSK3BAURKBMEN1
SCHEMBL7511156 0.72 MEN1 (0.49) LMNATDP1MEN1KMT2ASMN1; SMN2
SCHEMBL7078423 0.72 ALDH1A1 (0.51) LMNATDP1TYRMEN1KMT2A
SCHEMBL7481230 0.69 LMNA (0.43) LMNATYRROCK2PIM1GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1181292-A1 PYROZOLO [3,4-D][1,2,3] TRIAZINES WITH AN ANTICONVULSIVE ACTION AND METHODS FOR PRODUCING THE SAME ARZNEIMITTELWERK DRESDEN GMBH (DE) 2002-02-27 EP claimed
US-6316448-B1 Pyrazolo[3,4-d][1,2,3] troazines having anticonvulsant activity and process for their preparation ZENTARIS GMBH (DE) 2001-11-13 US claimed
WO-2000073309-A1 PYROZOLO [3,4-D][1,2,3] TRIAZINES WITH AN ANTICONVULSIVE ACTION AND METHODS FOR PRODUCING THE SAME ARZNEIMITTELWERK DRESDEN GMBH (DE) 2000-12-07 WO claimed
EP-1181292-A1 PYROZOLO [3,4-D][1,2,3] TRIAZINES WITH AN ANTICONVULSIVE ACTION AND METHODS FOR PRODUCING THE SAME ARZNEIMITTELWERK DRESDEN GMBH (DE) 2002-02-27 EP disclosed
US-6316448-B1 Pyrazolo[3,4-d][1,2,3] troazines having anticonvulsant activity and process for their preparation ZENTARIS GMBH (DE) 2001-11-13 US disclosed
WO-2000073309-A1 PYROZOLO [3,4-D][1,2,3] TRIAZINES WITH AN ANTICONVULSIVE ACTION AND METHODS FOR PRODUCING THE SAME ARZNEIMITTELWERK DRESDEN GMBH (DE) 2000-12-07 WO disclosed