SCHEMBL17809309

SCHEMBL17809309

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6cc7c8ccccc8n(-c8cccc9c8oc8ccccc89)c7cc65)c4)n3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.34
KDM4E B2RXH2 4/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 8/20 0.32
ALOX5 P09917 1/20 0.32
ALDH1A1 P00352 5/20 0.32
LMNA P02545 4/20 0.32
HSD17B10 Q99714 3/20 0.32
MAPK1 P28482 2/20 0.32
POLB P06746 2/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32
NPSR1 Q6W5P4 2/20 0.31
ALOX12 P18054 1/20 0.31
USP2 O75604 1/20 0.31
HTT P42858 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 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
SCHEMBL17809326 0.98 TSHR (0.35) TSHRKDM4EATML3MBTL1MAPT
SCHEMBL15786107 0.93 TSHR (0.34) TSHRKDM4EATML3MBTL1MAPT
SCHEMBL21365688 0.93 TSHR (0.35) TSHRKDM4EATML3MBTL1MAPT
SCHEMBL12088556 0.92 TSHR (0.33) TSHRKDM4EATML3MBTL1MAPT
SCHEMBL12088982 0.92 TSHR (0.33) TSHRKDM4EATML3MBTL1MAPT
SCHEMBL15786103 0.92 TSHR (0.34) TSHRKDM4EATML3MBTL1MAPT
SCHEMBL21740417 0.91 KDM4E (0.37) TSHRKDM4EATML3MBTL1ALDH1A1
SCHEMBL24914862 0.91 TSHR (0.35) TSHRKDM4EMAPTALOX5ALDH1A1
SCHEMBL17809148 0.90 MAPT (0.35) TSHRKDM4EATML3MBTL1MAPT
SCHEMBL21365779 0.90 KDM4E (0.36) TSHRKDM4EATML3MBTL1MAPT

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