Sugi Predict

Sugi Predict / Compounds / SCHEMBL23784475

SCHEMBL23784475

SCHEMBL23784475

C1=C(c2ccc(-n3c4ccccc4c4ccccc43)cc2)CCC(N(c2ccccc2)c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)=C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HDAC4 P56524 1/20 0.38
▸ REN P00797 1/20 0.32
▸ APP P05067 1/20 0.32
▸ PTPN1 P18031 2/20 0.31
▸ HTR7 P34969 1/20 0.30
▸ MAPK8 P45983 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ IL1R1 P14778 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
SCHEMBL18436205 0.97 L3MBTL1 (0.44) KDM4EATML3MBTL1HDAC4PTPN1
SCHEMBL22403429 0.97 L3MBTL1 (0.46) KDM4EATML3MBTL1HDAC4REN
SCHEMBL13557384 0.93 KDM4E (0.38) KDM4EATML3MBTL1HDAC4
SCHEMBL23894039 0.93 KDM4E (0.38) KDM4EATML3MBTL1HDAC4REN
SCHEMBL15752455 0.92 KDM4E (0.37) KDM4EATML3MBTL1HDAC4
SCHEMBL24972167 0.91 L3MBTL1 (0.41) KDM4EATML3MBTL1HDAC4REN
SCHEMBL22085289 0.89 L3MBTL1 (0.42) KDM4EATML3MBTL1HDAC4HTR7
SCHEMBL14234746 0.89 KDM4E (0.42) KDM4EATML3MBTL1HDAC4REN
SCHEMBL16124324 0.89 L3MBTL1 (0.42) KDM4EATML3MBTL1HDAC4HTR7
SCHEMBL19049053 0.89 KDM4E (0.36) KDM4EATML3MBTL1HDAC4

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-3439062-B1 ORGANIC LIGHT EMITTING ELEMENT LG CHEMICAL LTD (KR) 2021-09-08 — — EP disclosed
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