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Sugi Predict / Compounds / SCHEMBL18489088

SCHEMBL18489088

SCHEMBL18489088

CC1(C)c2ccc3c(c2C(C)(C)c2ccc4c(c21)c1ccccc1n4-c1cc(-c2ccccc2)cc(-c2ccccc2)c1)c1ccccc1n3-c1cc(-c2ccccc2)cc(-c2ccccc2)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ RARA P10276 1/20 0.33
▸ RARB P10826 1/20 0.33
▸ RARG P13631 1/20 0.33
▸ RORC P51449 1/20 0.32
▸ HSD11B1 P28845 1/20 0.30
▸ HDAC4 P56524 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
SCHEMBL18492455 0.92 ATM (0.40) KDM4EATML3MBTL1RARARARB
SCHEMBL18494579 0.89 L3MBTL1 (0.42) KDM4EATML3MBTL1RARARARB
SCHEMBL18489084 0.89 L3MBTL1 (0.41) KDM4EATML3MBTL1RARARARB
SCHEMBL16176132 0.87 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL18494591 0.86 KDM4E (0.34) KDM4EATML3MBTL1HSD11B1
SCHEMBL17989619 0.84 — —
SCHEMBL17989622 0.84 KDM4E (0.31) KDM4EATML3MBTL1
SCHEMBL18490791 0.83 KDM4E (0.44) KDM4EATML3MBTL1RORC
SCHEMBL21578716 0.83 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL21128994 0.83 L3MBTL1 (0.48) KDM4EATML3MBTL1HDAC4KMT2A

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
WO-2017023126-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 2017-02-09 — — WO disclosed
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