SCHEMBL22140657

SCHEMBL22140657

O=c1c2cccc(O)c2c2cccc3c4ccccc4n1c32

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
POLB P06746 3/20 0.59
HPGD P15428 3/20 0.59
KDM4E B2RXH2 3/20 0.59
HTT P42858 2/20 0.59
ALDH1A1 P00352 2/20 0.59
MAOA P21397 2/20 0.39
PTPN1 P18031 2/20 0.38
CYP1A2 P05177 3/20 0.37
CYP2C9 P11712 3/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 2/20 0.37
CASP1 P29466 2/20 0.37
HSD17B10 Q99714 2/20 0.37
APP P05067 1/20 0.37
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 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
SCHEMBL22140656 0.89 POLB (0.60) MAPTMEN1KMT2APOLBHPGD
SCHEMBL22140795 0.87 MAPT (0.51) MAPTMEN1KMT2APOLBHPGD
SCHEMBL12181279 0.81 KMT2A (0.62) MAPTMEN1KMT2APOLBHPGD
SCHEMBL22140773 0.81 MAPT (0.51) MAPTMEN1KMT2APOLBHPGD
SCHEMBL12324448 0.78 KDM4E (0.58) MAPTMEN1KMT2APOLBHPGD
SCHEMBL16260462 0.78 KMT2A (0.58) MAPTMEN1KMT2APOLBHPGD
SCHEMBL22140757 0.77 PTPN1 (0.53) MAPTMEN1KMT2APOLBHPGD
SCHEMBL29709994 0.77 POLB (0.53) MAPTMEN1KMT2APOLBHPGD
SCHEMBL22140800 0.76 MEN1 (0.57) MAPTMEN1KMT2APOLBHPGD
SCHEMBL22140798 0.76 MEN1 (0.57) MAPTMEN1KMT2APOLBHPGD

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-2020127165-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-06-25 WO disclosed