SCHEMBL26003205

SCHEMBL26003205

c1ccc(N(c2ccc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)c2ccc3cc(-c4ccc(N(c5ccc(-c6ccc(-c7ccc(-n8c9ccccc9c9ccccc98)cc7)cc6)cc5)c5cccc6ccccc56)cc4)ccc3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HDAC4 P56524 1/20 0.34
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
PRSS1 P07477 1/20 0.32
SIGMAR1 Q99720 3/20 0.32
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31
TUBB4B P68371 1/20 0.31
TUBB3 Q13509 1/20 0.31
TUBB2A Q13885 1/20 0.31
TUBB8 Q3ZCM7 1/20 0.31
TUBA3E Q6PEY2 1/20 0.31
TUBA1A Q71U36 1/20 0.31
TUBA1C Q9BQE3 1/20 0.31

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
SCHEMBL24743798 0.99 KDM4E (0.39) KDM4EATML3MBTL1HDAC4F2
SCHEMBL22925360 0.93 F2 (0.37) KDM4EATML3MBTL1HDAC4F2
SCHEMBL4629166 0.93 KDM4E (0.41) KDM4EATML3MBTL1HDAC4F2
SCHEMBL4618052 0.93 KDM4E (0.41) KDM4EATML3MBTL1HDAC4F2
SCHEMBL15138320 0.93 KDM4E (0.38) KDM4EATML3MBTL1HDAC4F2
SCHEMBL24221757 0.92 KDM4E (0.40) KDM4EATML3MBTL1F2F10
SCHEMBL16356550 0.92 L3MBTL1 (0.45) KDM4EATML3MBTL1HDAC4SIGMAR1
SCHEMBL21969018 0.91 F2 (0.32) KDM4EATML3MBTL1F2F10
SCHEMBL13803557 0.91 L3MBTL1 (0.39) KDM4EATML3MBTL1HDAC4ESR1
SCHEMBL10029900 0.91 KDM4E (0.35) KDM4EATML3MBTL1HDAC4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230210002-A1 COMPOSITION, AND ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-06-29 US disclosed