SCHEMBL21365537

SCHEMBL21365537

c1ccc(-c2ccc(-n3c4ccccc4c4c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc43)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
KDM4E B2RXH2 2/20 0.42
HDAC4 P56524 1/20 0.39
TSHR P16473 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
ALOX15 P16050 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA2B P29275 1/20 0.36
ADORA1 P30542 1/20 0.36
PDE6D O43924 1/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
NFKB1 P19838 1/20 0.35
MAPK1 P28482 1/20 0.35
NFKB2 Q00653 1/20 0.35

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
SCHEMBL24272982 1.00 ATM (0.42) ATML3MBTL1KDM4EHDAC4TSHR
SCHEMBL22386967 1.00 ATM (0.42) ATML3MBTL1KDM4EHDAC4TSHR
SCHEMBL24152522 0.97 KDM4E (0.47) ATML3MBTL1KDM4EHDAC4TSHR
SCHEMBL24272984 0.96 ATM (0.39) ATML3MBTL1KDM4EHDAC4TSHR
SCHEMBL24272993 0.96 ATM (0.39) ATML3MBTL1KDM4EHDAC4TSHR
SCHEMBL24152061 0.96 KDM4E (0.49) ATML3MBTL1KDM4EHDAC4TSHR
SCHEMBL24272980 0.95 KDM4E (0.38) ATML3MBTL1KDM4EHDAC4TSHR
SCHEMBL24272991 0.95 KDM4E (0.38) ATML3MBTL1KDM4EHDAC4TSHR
SCHEMBL24272994 0.95 KDM4E (0.38) ATML3MBTL1KDM4EHDAC4TSHR
SCHEMBL24272989 0.95 KDM4E (0.38) ATML3MBTL1KDM4EHDAC4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3767698-B1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MAT CO LTD (JP) 2023-10-25 EP disclosed
US-20210119144-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2021-04-22 US disclosed
EP-3767698-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL Chemical & Material Co., Ltd. (JP) 2021-01-20 EP disclosed
WO-2019176605-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 日鉄ケミカル&マテリアル株式会社 2019-09-19 WO disclosed