SCHEMBL17809299

SCHEMBL17809299

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)c7c65)c4)n3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ATM Q13315 1/20 0.43
RAC2 P15153 1/20 0.36
RAC3 P60763 1/20 0.36
CDC42 P60953 1/20 0.36
RAC1 P63000 1/20 0.36
PTGER4 P35408 1/20 0.36
HDAC4 P56524 1/20 0.35
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
GAA P10253 2/20 0.34
AVPR1A P37288 1/20 0.33
NR3C1 P04150 1/20 0.33
IL1R1 P14778 1/20 0.33
ABCG2 Q9UNQ0 3/20 0.32
ALDH1A1 P00352 3/20 0.32
RXRA P19793 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 2/20 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
SCHEMBL17809292 0.98 L3MBTL1 (0.45) L3MBTL1KDM4EATMRAC2RAC3
SCHEMBL25473556 0.97 L3MBTL1 (0.40) L3MBTL1KDM4EATMRAC2RAC3
SCHEMBL25473632 0.97 L3MBTL1 (0.40) L3MBTL1KDM4EATMRAC2RAC3
SCHEMBL25473921 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMRAC2RAC3
SCHEMBL25473922 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMRAC2RAC3
SCHEMBL25966432 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMPTGER4HDAC4
SCHEMBL24078790 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMPTGER4HDAC4
SCHEMBL25966529 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMPTGER4HDAC4
SCHEMBL17809127 0.95 L3MBTL1 (0.44) L3MBTL1KDM4EATMHDAC4KMT2A
SCHEMBL15910230 0.95 L3MBTL1 (0.47) L3MBTL1KDM4EATMRAC2RAC3

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-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed
US-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed