SCHEMBL16437599

SCHEMBL16437599

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c5oc6c(ccc7oc8ccccc8c76)c5ccc43)n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.32
MAPT P10636 5/20 0.32
MEN1 O00255 5/20 0.32
MAPK1 P28482 4/20 0.32
ALDH1A1 P00352 4/20 0.32
NPSR1 Q6W5P4 3/20 0.32
TSHR P16473 3/20 0.32
NPC1 O15118 2/20 0.32
GAA P10253 2/20 0.32
POLB P06746 2/20 0.32
LMNA P02545 1/20 0.32
ALOX12 P18054 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP3A4 P08684 4/20 0.32
HPGD P15428 4/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
CA12 O43570 1/20 0.32
TNKS O95271 1/20 0.32

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
SCHEMBL13183745 0.92 MAPT (0.34) KMT2AMAPTMEN1MAPK1ALDH1A1
SCHEMBL11933009 0.92 MAPT (0.36) KMT2AMAPTMEN1MAPK1ALDH1A1
SCHEMBL15625582 0.90 PTPRF (0.36) KMT2AMAPTMEN1MAPK1ALDH1A1
SCHEMBL9881133 0.90 MEN1 (0.33) KMT2AMAPTMEN1MAPK1ALDH1A1
SCHEMBL15625580 0.90 MEN1 (0.33) KMT2AMAPTMEN1MAPK1ALDH1A1
SCHEMBL15625544 0.90 MAPK1 (0.34) KMT2AMAPTMEN1MAPK1ALDH1A1
SCHEMBL16437587 0.89 ALDH1A1 (0.35) KMT2AMAPTMEN1MAPK1ALDH1A1
SCHEMBL9890028 0.88 MAPT (0.32) KMT2AMAPTMEN1MAPK1ALDH1A1
SCHEMBL16160468 0.87 PLA2G2A (0.34) KMT2AMAPTMEN1MAPK1ALDH1A1
SCHEMBL16484295 0.87 L3MBTL1 (0.40) KMT2AMAPTMEN1MAPK1ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9755157-B2 Organic compound and organic optoelectric device and display device CHEIL INDUSTRIES, INC. (KR) 2017-09-05 US disclosed
US-9755157-B2 Organic compound and organic optoelectric device and display device CHEIL INDUSTRIES, INC. (KR) 2017-09-05 US disclosed
US-20150034914-A1 ORGANIC COMPOUND AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE CHEIL INDUSTRIES, INC. (KR) 2015-02-05 US disclosed
US-20150034914-A1 ORGANIC COMPOUND AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE CHEIL INDUSTRIES, INC. (KR) 2015-02-05 US disclosed