SCHEMBL10429355

SCHEMBL10429355

O=c1[nH]nnc2c1cnn2-c1cccc(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DAPK3 O43293 2/20 0.52
PIM1 P11309 2/20 0.52
PIM3 Q86V86 2/20 0.52
PIM2 Q9P1W9 2/20 0.52
DAPK1 P53355 1/20 0.49
DAPK2 Q9UIK4 1/20 0.49
GRM1 Q13255 1/20 0.49
TP53 P04637 7/20 0.46
MAPT P10636 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TSHR P16473 1/20 0.45
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 4/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL10429315 0.84 ALDH1A1 (0.50) DAPK3PIM1PIM3TP53MAPT
SCHEMBL10429338 0.82 KMT2A (0.46) TP53MAPTHPGDKMT2ASMN1; SMN2
SCHEMBL19342122 0.76 DAPK3 (0.61) DAPK3PIM1PIM3PIM2DAPK1
SCHEMBL19342126 0.74 DAPK3 (0.70) DAPK3PIM1PIM3PIM2DAPK1
SCHEMBL10429308 0.73 SMN1; SMN2 (0.50) TP53MAPTALDH1A1HPGDKDM4E
SCHEMBL10429351 0.73 LMNA (0.44) TP53MAPTALDH1A1KDM4ETSHR
SCHEMBL2786336 0.70 GRM1 (0.55) DAPK3PIM1PIM3PIM2DAPK1
SCHEMBL6224500 0.70 MAPT (0.65) TP53MAPTALDH1A1HPGDKDM4E
SCHEMBL19342056 0.69 DAPK3 (0.73) DAPK3PIM1PIM3PIM2DAPK1
SCHEMBL8306675 0.69 PDE9A (0.73) DAPK3PIM1PIM3PIM2DAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274654-A2 1,2,3-Triazin-4(3H)-one derivatives, process for their preparation and medicaments containing them F. HOFFMANN-LA ROCHE AG (CH) 1988-07-20 EP claimed
US-4920119-A XANTHINE OXIDASE INHIBITORS; CONTROL OR PREVENTION OF GOUT OR ISCHEMIA HOFFMANN-LA ROCHE INC. (US) 1990-04-24 US disclosed
EP-0274654-A2 1,2,3-Triazin-4(3H)-one derivatives, process for their preparation and medicaments containing them F. HOFFMANN-LA ROCHE AG (CH) 1988-07-20 EP disclosed