SCHEMBL1985170

SCHEMBL1985170

O=C(Nc1ccc(N=Nc2ccc(NC(=O)c3ccccc3)cc2)cc1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.69
MEN1 O00255 3/20 0.69
KMT2A Q03164 3/20 0.69
HTT P42858 1/20 0.69
PTPN1 P18031 3/20 0.69
NPC1 O15118 7/20 0.67
RAB9A P51151 7/20 0.67
SIRT1 Q96EB6 1/20 0.67
KDM4E B2RXH2 1/20 0.67
POLB P06746 1/20 0.67
SMN1; SMN2 Q16637 3/20 0.65
CACNA1B Q00975 1/20 0.62
APBA1 Q02410 1/20 0.62
MAPK1 P28482 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
PRMT1 Q99873 1/20 0.61
FFAR1 O14842 1/20 0.61
PGR P06401 1/20 0.61
JAK2 O60674 1/20 0.59
TYK2 P29597 1/20 0.59

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
SCHEMBL30963829 0.98 MAPT (0.72) MAPTMEN1KMT2AHTTPTPN1
SCHEMBL14130013 0.94 MAPT (0.68) MAPTMEN1KMT2AHTTPTPN1
SCHEMBL2285475 0.92 PRMT1 (0.66) MAPTMEN1KMT2AHTTPTPN1
SCHEMBL2285472 0.92 PRMT1 (0.66) MAPTMEN1KMT2AHTTPTPN1
SCHEMBL17472006 0.91 PTPN1 (0.67) MAPTMEN1KMT2AHTTPTPN1
SCHEMBL20194015 0.91 PTPN1 (0.67) MAPTMEN1KMT2AHTTPTPN1
SCHEMBL14130392 0.90 PTPN1 (0.72) MAPTMEN1KMT2AHTTPTPN1
SCHEMBL14130010 0.90 KMT2A (0.81) MAPTMEN1KMT2AHTTPTPN1
SCHEMBL14130163 0.89 MEN1 (0.70) MAPTMEN1KMT2AHTTPTPN1
SCHEMBL126415 0.88 PTPN1 (0.87) MAPTMEN1KMT2APTPN1NPC1

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-1523415-B1 SECURITY FEATURE FOR VALUE DOCUMENTS LANDQART (CH) 2011-06-29 EP disclosed