SCHEMBL17039387

SCHEMBL17039387

c1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5c6ccccc6ccc54)n4ccccc34)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ RAD51 Q06609 9/20 0.36
▸ HIF1A Q16665 3/20 0.36
▸ EPAS1 Q99814 3/20 0.36
▸ RORC P51449 3/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ MAP2K3 P46734 1/20 0.33

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
SCHEMBL17039396 0.93 MEN1 (0.35) MEN1KMT2APOLBGAAHPGD
SCHEMBL17039384 0.92 RAD51 (0.37) MEN1KMT2APOLBGAAHPGD
SCHEMBL17039383 0.92 RAD51 (0.35) MEN1KMT2APOLBGAAHPGD
SCHEMBL17039391 0.90 ENPP3 (0.36) MEN1KMT2APOLBGAAHPGD
SCHEMBL17039393 0.89 RAD51 (0.47) MEN1KMT2APOLBGAAHPGD
SCHEMBL17039386 0.88 MEN1 (0.33) MEN1KMT2APOLBGAAHPGD
SCHEMBL17039371 0.87 MEN1 (0.46) MEN1KMT2APOLBGAAHPGD
SCHEMBL17039388 0.85 RAD51 (0.36) MEN1KMT2APOLBGAAHPGD
SCHEMBL17039575 0.84 KMT2A (0.48) MEN1KMT2APOLBGAAHPGD
SCHEMBL17039406 0.84 ALDH1A1 (0.33) HPGDKDM4EALDH1A1MAPTHIF1A

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