SCHEMBL20146443

SCHEMBL20146443

Brc1ccc(C2C=CC=C(c3ccc4c(c3)c3ccccc3n4-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)C2)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.35
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
EGFR P00533 2/20 0.30
ERBB2 P04626 2/20 0.30
ACHE P22303 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 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
SCHEMBL21667200 0.84 HDAC4 (0.38) HDAC4KDM4EATML3MBTL1
SCHEMBL19452632 0.81 HDAC4 (0.35) HDAC4KDM4EATML3MBTL1
SCHEMBL20073137 0.81 HDAC4 (0.38) HDAC4KDM4EATML3MBTL1
SCHEMBL15790366 0.79 ATM (0.43) HDAC4KDM4EATML3MBTL1EGFR
SCHEMBL26705705 0.77 KDM4E (0.33) HDAC4KDM4EATML3MBTL1
SCHEMBL26178246 0.77 L3MBTL1 (0.41) HDAC4KDM4EATML3MBTL1ALDH1A1
SCHEMBL16720878 0.76 ATM (0.46) HDAC4KDM4EATML3MBTL1ALDH1A1
SCHEMBL16720924 0.76 ATM (0.46) HDAC4KDM4EATML3MBTL1ALDH1A1
SCHEMBL16986004 0.75 ATM (0.46) HDAC4KDM4EATML3MBTL1EGFR
SCHEMBL21300839 0.75 KDM4E (0.36) HDAC4KDM4EATML3MBTL1

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
EP-3321341-A1 ORGANIC ELECTRONIC ELEMENT USING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF Duk San Neolux Co., Ltd. (KR) 2018-05-16 EP disclosed