SCHEMBL16613274

SCHEMBL16613274

CC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccccc5c5ccccc54)nc4c3ccn4-c3ccccc3)c21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
DUSP3 P51452 1/20 0.31
HKDC1 Q2TB90 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
SCHEMBL16613638 0.92 PTGER4 (0.32) KDM4EATML3MBTL1
SCHEMBL16613517 0.91
SCHEMBL16613236 0.91 DUSP3 (0.31) DUSP3
SCHEMBL16613574 0.85 KDM4E (0.31) KDM4EATML3MBTL1DUSP3
SCHEMBL16613290 0.82 KDM4E (0.37) KDM4EATML3MBTL1DUSP3HKDC1
SCHEMBL16613367 0.82 KDM4E (0.40) KDM4EATML3MBTL1DUSP3HKDC1
SCHEMBL16613312 0.81 KDM4E (0.36) KDM4EATML3MBTL1DUSP3
SCHEMBL16613311 0.80 KDM4E (0.37) KDM4EATML3MBTL1DUSP3HKDC1
SCHEMBL16613382 0.80 KDM4E (0.31) PGRKDM4EATML3MBTL1
SCHEMBL16613571 0.79 DUSP3 (0.30) DUSP3

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed