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Sugi Predict / Compounds / SCHEMBL17033726

SCHEMBL17033726

SCHEMBL17033726

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccc(N(c6ccccc6)c6ccccc6)cc5c5cc6cc7c8ccccc8c8ccccc8n7c6cc54)c3)n2)cc1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ PTGER4 P35408 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
SCHEMBL17033753 0.94 KDM4E (0.32) KDM4EATML3MBTL1PTGER4
SCHEMBL17033612 0.90 KDM4E (0.38) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL22079204 0.89 KDM4E (0.39) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL17033773 0.88 PTGER4 (0.34) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL17033728 0.88 KDM4E (0.37) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL17033467 0.87 KDM4E (0.39) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL18565218 0.87 KDM4E (0.39) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL17033771 0.87 KDM4E (0.31) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL18566538 0.85 KDM4E (0.40) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL17879034 0.85 KDM4E (0.37) KDM4EMEN1ALDH1A1LMNAMAPT

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-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 — — WO disclosed