SCHEMBL19003923

SCHEMBL19003923

C1=Cc2c(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc3n2-c2ccc3c4ccccc4c4ccccc4c3c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
HDAC4 P56524 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
SCHEMBL17920279 1.00 KDM4E (0.39) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL26252230 0.97 KDM4E (0.42) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL21074308 0.95 KDM4E (0.35) KDM4EATML3MBTL1HDAC4
SCHEMBL20391695 0.94 KDM4E (0.40) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL18903134 0.93 L3MBTL1 (0.45) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL21923270 0.93 ATM (0.38) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL21923269 0.91 ATM (0.36) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL17012686 0.91 ATM (0.39) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL19791137 0.91 KDM4E (0.40) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL21215412 0.90 KDM4E (0.40) KDM4EATML3MBTL1HDAC4PTGER4

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-2017104946-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2017-06-22 WO disclosed