SCHEMBL8640958

SCHEMBL8640958

c1ccc(Nc2ccc(-c3ccc(Nc4ccc(Oc5ccc(Nc6ccc(-c7ccc(Nc8ccccc8)cc7)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
HSD17B10 Q99714 3/20 0.59
L3MBTL1 Q9Y468 3/20 0.59
ALOX12 P18054 2/20 0.59
TSHR P16473 2/20 0.59
PTGS2 P35354 2/20 0.59
MAPK1 P28482 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
ALOX15 P16050 1/20 0.59
PTGS1 P23219 1/20 0.59
SLC6A2 P23975 1/20 0.59
HTR2B P41595 1/20 0.59
MAPT P10636 5/20 0.50
GAA P10253 2/20 0.50
HSP90AA1 P07900 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PTPN7 P35236 1/20 0.48
PTPN12 Q05209 1/20 0.48
HPGD P15428 3/20 0.48

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
SCHEMBL16343963 0.93 LTA4H (0.52) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR
SCHEMBL13308524 0.93 ALDH1A1 (0.68) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR
SCHEMBL8626416 0.93 ALDH1A1 (0.68) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR
SCHEMBL7514685 0.91 ALDH1A1 (0.65) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR
SCHEMBL17948198 0.88 LTA4H (0.63) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR
SCHEMBL14435643 0.88 LTA4H (0.63) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR
SCHEMBL2852700 0.85 ALDH1A1 (0.81) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR
SCHEMBL67901 0.85 ALDH1A1 (0.81) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR
SCHEMBL17965666 0.85 ALDH1A1 (0.81) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR
SCHEMBL10079561 0.83 ALDH1A1 (0.77) ALDH1A1HSD17B10L3MBTL1ALOX12TSHR

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
EP-0650955-B1 Amine compound and electro-luminescence device comprising same HODOGAYA CHEMICAL CO LTD (JP) 1998-08-19 EP disclosed
US-5707747-A CHARGE TRANSPORT COMPOUNDS HODOGAYA CHEMICAL CO., LTD. (JP) 1998-01-13 US disclosed
US-5639914-A DURABLE, STABLE, LOW VOLTAGE ELECTROLUMINESCENT EMITTERS HODOGAYA CHEMICAL CO., LTD. (JP) 1997-06-17 US disclosed
EP-0650955-A1 Amine compound and electro-luminescence device comprising same HODOGAYA CHEMICAL CO., LTD. (JP) 1995-05-03 EP disclosed