SCHEMBL19986019

SCHEMBL19986019

c1ccc2c(-c3ccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)cc3)cccc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.33
ENPP1 P22413 1/20 0.33
ALOX5 P09917 1/20 0.33
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA9 Q16790 3/20 0.33
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CDC14B O60729 2/20 0.30
CDC14A Q9UNH5 2/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL17427576 0.93 ENPP3 (0.34) ENPP3ENPP1ALOX5CA12CA1
SCHEMBL19986090 0.91 ALOX5 (0.34) ALOX5L3MBTL1KDM4EALDH1A1CDC14B
SCHEMBL19986101 0.90 ALOX5 (0.33) ALOX5CDC14BCDC14A
SCHEMBL19986067 0.90 ALOX5 (0.44) ALOX5KDM4EALDH1A1CDC14BCDC14A
SCHEMBL19986049 0.89 ALOX5 (0.34) ALOX5TDP1L3MBTL1KDM4EALDH1A1
SCHEMBL19986023 0.89 ALDH1A1 (0.32) ALOX5L3MBTL1KDM4EALDH1A1HPGD
SCHEMBL17427717 0.89 ENPP3 (0.33) ENPP3ENPP1ALOX5CA12CA1
SCHEMBL19986063 0.88 KDM4E (0.37) ALOX5CA12CA9L3MBTL1KDM4E
SCHEMBL19986076 0.88 KDM4E (0.37) ALOX5CA12CA9L3MBTL1KDM4E
SCHEMBL19986042 0.86 KDM4E (0.37) CA12CA9HDAC6L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed