SCHEMBL22808559

SCHEMBL22808559

COc1ccc(Nc2nc(Nc3ccccc3C)nc(Nc3ccccc3C)n2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
GAA P10253 2/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
ALDH1A1 P00352 4/20 0.57
KCNH3 Q9ULD8 3/20 0.57
RAB9A P51151 3/20 0.57
MAPK1 P28482 2/20 0.57
NPC1 O15118 1/20 0.57
TP53 P04637 1/20 0.57
NPY5R Q15761 1/20 0.52
MERTK Q12866 1/20 0.51
LMNA P02545 1/20 0.51
PKM P14618 1/20 0.51
PKLR P30613 1/20 0.51
PDE4B Q07343 1/20 0.50
PDE4D Q08499 1/20 0.50
KDM4E B2RXH2 1/20 0.50

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
SCHEMBL12316964 0.89 KCNH3 (0.51) MAPTMEN1KMT2ASMN1; SMN2GAA
SCHEMBL10480098 0.87 ALDH1A1 (0.65) MAPTMEN1KMT2ASMN1; SMN2GAA
SCHEMBL4544869 0.84 KCNH3 (0.58) MAPTMEN1KMT2AGAAKCNH3
SCHEMBL4544824 0.84 KCNH3 (0.60) MAPTMEN1KMT2AGAAKCNH3
SCHEMBL4544844 0.83 KCNH3 (0.55) MAPTMEN1KMT2ASMN1; SMN2GAA
SCHEMBL4544837 0.83 KCNH3 (0.55) MAPTMEN1KMT2ASMN1; SMN2GAA
SCHEMBL4544839 0.83 SLC2A1 (0.65) MAPTMEN1KMT2ASMN1; SMN2GAA
SCHEMBL4544852 0.83 SLC2A1 (0.65) MAPTMEN1KMT2ASMN1; SMN2GAA
SCHEMBL10073747 0.83 KCNH3 (0.77) MAPTMEN1KMT2ASMN1; SMN2GAA
SCHEMBL10099686 0.83 KCNH3 (0.77) MAPTMEN1KMT2ASMN1; SMN2GAA

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
US-10871597-B2 Polarizing plate, image display device, and polarizing plate protective film FUJIFILM CORPORATION (JP) 2020-12-22 US disclosed