SCHEMBL14296016

SCHEMBL14296016

c1ccc(-n2c3ccccc3c3cccc(-c4cccc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)n4)c32)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.55
▸ ATM Q13315 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ DUSP3 P51452 1/20 0.44
▸ MAPK1 P28482 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ RECQL P46063 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MAPK8 P45983 1/20 0.36
▸ IL1R1 P14778 1/20 0.36
▸ TUBB4A P04350 1/20 0.35
▸ TUBB P07437 1/20 0.35
▸ TUBA3C P0DPH7 1/20 0.35
▸ TUBA1B P68363 1/20 0.35
▸ TUBA4A P68366 1/20 0.35
▸ TUBB4B P68371 1/20 0.35
▸ TUBB3 Q13509 1/20 0.35
▸ TUBB2A Q13885 1/20 0.35
▸ TUBB8 Q3ZCM7 1/20 0.35
▸ TUBA3E Q6PEY2 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
SCHEMBL14296091 0.98 KDM4E (0.53) KDM4EATML3MBTL1DUSP3MAPK1
SCHEMBL14296129 0.95 KDM4E (0.50) KDM4EATML3MBTL1DUSP3MAPK1
SCHEMBL14296106 0.91 L3MBTL1 (0.46) KDM4EATML3MBTL1DUSP3HTT
SCHEMBL14296071 0.89 KDM4E (0.55) KDM4EATML3MBTL1DUSP3MAPK1
SCHEMBL14296090 0.89 L3MBTL1 (0.44) KDM4EATML3MBTL1DUSP3HTT
SCHEMBL14296093 0.89 L3MBTL1 (0.44) KDM4EATML3MBTL1DUSP3MAPK1
SCHEMBL14296109 0.88 L3MBTL1 (0.42) KDM4EATML3MBTL1DUSP3HTT
SCHEMBL14296079 0.88 L3MBTL1 (0.49) KDM4EATML3MBTL1DUSP3MAPK1
SCHEMBL20706844 0.88 L3MBTL1 (0.65) KDM4EATML3MBTL1DUSP3MAPK1
SCHEMBL30017427 0.88 L3MBTL1 (0.65) KDM4EATML3MBTL1DUSP3MAPK1

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
US-8986858-B2 Organic electroluminescent device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2015-03-24 — — US disclosed
US-8986858-B2 Organic electroluminescent device NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2015-03-24 — — US disclosed
US-20120319095-A1 ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL CHEMICAL CO., LTD. (JP) 2012-12-20 — — US disclosed
US-20120319095-A1 ORGANIC ELECTROLUMINESCENT DEVICE NIPPON STEEL CHEMICAL CO., LTD. (JP) 2012-12-20 — — US disclosed
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