SCHEMBL19061285

SCHEMBL19061285

CC1(C)c2ccccc2-c2ccc(-c3ccccc3-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4nc(-c5ccc(-c6ccccc6)cc5)nc(-c5ccc(-c6ccccc6)cc5)n4)cc3)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 3/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HDAC4 P56524 1/20 0.34
▸ RAC2 P15153 1/20 0.33
▸ RAC3 P60763 1/20 0.33
▸ CDC42 P60953 1/20 0.33
▸ RAC1 P63000 1/20 0.33
▸ NPY5R Q15761 1/20 0.32
▸ PDK2 Q15119 1/20 0.32
▸ TSPO P30536 1/20 0.32
▸ RXRA P19793 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ AKR1C4 P17516 1/20 0.30
▸ AKR1C3 P42330 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
SCHEMBL19061805 0.99 KDM4E (0.35) PTGER4KDM4EATML3MBTL1HDAC4
SCHEMBL19061255 0.97 KDM4E (0.35) PTGER4KDM4EATML3MBTL1HDAC4
SCHEMBL19061226 0.95 PTGER4 (0.34) PTGER4KDM4EATML3MBTL1HDAC4
SCHEMBL19061845 0.95 MEN1 (0.35) PTGER4KDM4EATML3MBTL1HDAC4
SCHEMBL22058775 0.94 KDM4E (0.36) PTGER4KDM4EATML3MBTL1RAC2
SCHEMBL18385499 0.94 PTGER4 (0.35) PTGER4KDM4EATML3MBTL1HDAC4
SCHEMBL18385479 0.94 PTGER4 (0.35) PTGER4KDM4EATML3MBTL1HDAC4
SCHEMBL18385214 0.94 PTGER4 (0.35) PTGER4KDM4EATML3MBTL1HDAC4
SCHEMBL18385194 0.94 PTGER4 (0.35) PTGER4KDM4EATML3MBTL1HDAC4
SCHEMBL18385183 0.94 PTGER4 (0.35) PTGER4KDM4EATML3MBTL1HDAC4

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-2017111389-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DIODE INCLUDING SAME 주식회사 두산 2017-06-29 — — WO disclosed
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