SCHEMBL7473989

SCHEMBL7473989

O=C1CNN(Cc2ccccc2)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
GSK3A P49840 4/20 0.47
GSK3B P49841 4/20 0.47
F2 P00734 1/20 0.44
PLG P00747 1/20 0.44
ELANE P08246 1/20 0.44
CTSG P08311 1/20 0.44
CMA1 P23946 1/20 0.44
CTRC Q99895 1/20 0.44
EPHX2 P34913 1/20 0.41
MGLL Q99685 1/20 0.41
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41
SIGMAR1 Q99720 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL3860653 0.80 GAA (0.53) GAAGSK3AGSK3BF2PLG
SCHEMBL2438031 0.74 SIGMAR1 (0.60) GAAGSK3AGSK3BF2PLG
SCHEMBL27538197 0.69 SMN1; SMN2 (0.50) GAASIGMAR1MEN1KMT2AALDH1A1
SCHEMBL5075479 0.67 SIGMAR1 (0.56) GAAGSK3AGSK3BF2PLG
SCHEMBL9193147 0.67 ALOX5 (0.46) GAAGSK3AGSK3BMEN1KMT2A
SCHEMBL8553203 0.67 GAA (0.50) GAAGSK3AGSK3BF2PLG
SCHEMBL11136048 0.67 GAA (1.00) GAAGSK3AGSK3BF2PLG
SCHEMBL6734920 0.67 GSK3A (0.47) GAAGSK3AGSK3BF2PLG
SCHEMBL1488276 0.66 L3MBTL1 (0.56) GSK3AGSK3BF2PLGELANE
SCHEMBL11085801 0.66 DDB1 (0.51) GAAGSK3AGSK3BF2PLG

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
EP-1005471-B1 PYRAZOLO(3,4-D)PYRIMIDINES WITH ANTICONVULSIVE AND ANTIALLERGIC/ANTIASTHMATIC ACTION DRESDEN ARZNEIMITTEL (DE) 2002-09-04 EP disclosed