SCHEMBL7255702

SCHEMBL7255702

Clc1ccccc1-c1cc2c(/N=C/c3ccccc3)n[nH]c2nn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPL P05186 2/20 0.38
MAOB P27338 1/20 0.36
MAPT P10636 7/20 0.35
KDM4E B2RXH2 2/20 0.35
HTT P42858 1/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
LMNA P02545 3/20 0.35
POLB P06746 3/20 0.35
HPGD P15428 3/20 0.35
MAPK1 P28482 2/20 0.35
ATM Q13315 1/20 0.35
IDO1 P14902 1/20 0.35
LDHA P00338 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.33
CTH P32929 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GFER P55789 1/20 0.33
ALOX15 P16050 2/20 0.33

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
SCHEMBL7255711 1.00 ALPL (0.38) ALPLMAOBMAPTKDM4EHTT
SCHEMBL7256504 0.75 JAK2 (0.51) ALPLMAOBMAPTKDM4EMEN1
SCHEMBL7259137 0.71 CYP1A2 (0.50) ALPLKMT2AHPGDMAPK1ALDH1A1
SCHEMBL7126825 0.69 GSK3B (0.48) CLK4GSK3AFAAH
SCHEMBL7126823 0.69 GSK3B (0.48) CLK4GSK3AFAAH
SCHEMBL2491365 0.64 HPGD (0.36) MAPTHTTMEN1KMT2ASMN1; SMN2
SCHEMBL3462734 0.64 HPGD (0.36) MAPTHTTMEN1KMT2ASMN1; SMN2
SCHEMBL29768210 0.64 GAA (0.37) MAPTKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL26675427 0.64 GAA (0.37) MAPTKDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL10946287 0.60 CNR2 (0.56) ALPLMAOBKDM4ESMN1; SMN2LMNA

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-2003080616-A1 PYRAZOLOPYRIDAZINE DERIVATIVES, PROCESS FOR PREPARATION AND USE FOR THE INHIBITION OF GSK-3 GLAXO GROUP LIMITED (GB) 2003-10-02 WO disclosed