SCHEMBL19985909

SCHEMBL19985909

c1ccc(-n2c3ccccc3c3ccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7sc6c54)cc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HSD17B10 Q99714 1/20 0.34
MAPT P10636 4/20 0.34
RXFP1 Q9HBX9 2/20 0.34
TP53 P04637 4/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 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
SCHEMBL19985940 0.93 ATM (0.43) ATMKDM4EL3MBTL1HSD17B10MAPT
SCHEMBL19985942 0.92 KDM4E (0.40) ATMKDM4EL3MBTL1HSD17B10MAPT
SCHEMBL19985948 0.91 ATM (0.43) ATMKDM4EL3MBTL1HSD17B10MAPT
SCHEMBL19985945 0.90 KDM4E (0.40) ATMKDM4EL3MBTL1HSD17B10MAPT
SCHEMBL19985974 0.90 KDM4E (0.38) ATMKDM4EL3MBTL1HSD17B10MAPT
SCHEMBL19985927 0.90 ATM (0.44) ATMKDM4EL3MBTL1HSD17B10MAPT
SCHEMBL19985972 0.89 TP53 (0.35) ATMKDM4EL3MBTL1MAPTRXFP1
SCHEMBL18960869 0.88 ATM (0.43) ATMKDM4EL3MBTL1HSD17B10MAPT
SCHEMBL17405811 0.88 ATM (0.38) ATMKDM4EL3MBTL1HSD17B10MAPT
SCHEMBL17406041 0.88 ATM (0.38) ATMKDM4EL3MBTL1HSD17B10MAPT

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