SCHEMBL19986117

SCHEMBL19986117

c1ccc2c(-c3ccc4sc5ccccc5c4c3)nc(-n3c4ccccc4c4c5c6ccccc6c6ccccc6c5c5c6ccccc6oc5c43)nc2c1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 3/20 0.31
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
MAPK1 P28482 1/20 0.30
ATM Q13315 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL19986114 0.94 KDM4E (0.32) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL17405347 0.92 KDM4E (0.30) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL19986119 0.91 ALDH1A1 (0.35) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL22199807 0.90 KDM4E (0.32) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL17405351 0.89 KDM4E (0.30) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL17405343 0.89 KDM4E (0.31) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL19986113 0.89 ALDH1A1 (0.34) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL19986106 0.88 ALDH1A1 (0.33) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL19986109 0.87 ALDH1A1 (0.34) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL19986104 0.87 ALDH1A1 (0.34) KDM4EALDH1A1HPGDMAPTNPSR1

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