SCHEMBL17039575

SCHEMBL17039575

c1ccc(-c2nc(-n3c4ccccc4c4ccccc43)n3ccccc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ KDM4E B2RXH2 3/20 0.47
▸ MAPT P10636 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ HIF1A Q16665 2/20 0.43
▸ EPAS1 Q99814 2/20 0.43
▸ RAD51 Q06609 8/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ MAP2K3 P46734 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ RORC P51449 2/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL17039371 0.97 MEN1 (0.46) KMT2AMEN1NPSR1POLBGAA
SCHEMBL17039379 0.91 MEN1 (0.41) KMT2AMEN1NPSR1POLBGAA
SCHEMBL17039374 0.90 RAD51 (0.43) KMT2AMEN1NPSR1POLBGAA
SCHEMBL17039378 0.89 RAD51 (0.56) KMT2AMEN1NPSR1POLBGAA
SCHEMBL17039380 0.88 MEN1 (0.38) KMT2AMEN1NPSR1POLBGAA
SCHEMBL17039376 0.88 HPGD (0.38) KMT2AMEN1NPSR1POLBGAA
SCHEMBL17039398 0.87 KDM4E (0.44) KMT2AMEN1NPSR1POLBGAA
SCHEMBL17039527 0.86 KDM4E (0.43) KMT2AMEN1NPSR1POLBGAA
SCHEMBL17039372 0.84 ENPP3 (0.40) KMT2AMEN1NPSR1POLBGAA
SCHEMBL17039387 0.84 MEN1 (0.39) KMT2AMEN1NPSR1POLBGAA

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-2015126161-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 — — WO disclosed
Send feedback