SCHEMBL13263436

SCHEMBL13263436

CC(C)(C)c1ccc(-n2c3ccc(-n4c5c(c6ccccc64)CCC=C5)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 4/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PPARA Q07869 2/20 0.34
▸ PMM2 O15305 1/20 0.31
▸ MPI P34949 1/20 0.31
▸ PHOSPHO1 Q8TCT1 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL13263440 0.93 KDM4E (0.36) PPARGKDM4EATML3MBTL1PPARA
SCHEMBL18951592 0.89 KDM4E (0.39) PPARGKDM4EATML3MBTL1
SCHEMBL10071775 0.87 KDM4E (0.39) KDM4EATML3MBTL1
SCHEMBL20073479 0.87 KDM4E (0.39) KDM4EATML3MBTL1
SCHEMBL24799637 0.86 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL19541509 0.86 KDM4E (0.40) KDM4EATML3MBTL1
SCHEMBL14133187 0.86 GPR3 (0.40) KDM4EL3MBTL1ALDH1A1MAPTMAPK1
SCHEMBL12283743 0.85 PPARG (0.33) PPARGKDM4EATML3MBTL1
SCHEMBL18884541 0.85 — —
SCHEMBL14050165 0.85 KDM4E (0.47) KDM4EATML3MBTL1

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-20100171418-A1 ORGANIC ELECTROLUMINESCENT DEVICE FUJIFILM CORPORATION (JP) 2010-07-08 — — US disclosed
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