SCHEMBL27390259

SCHEMBL27390259

C1=Cc2c(c3cc(-c4ccc5c6ccccc6n(-c6cccc(-c7ccccc7)c6)c5c4)ccc3n2-c2ccc(-c3ccccc3)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HDAC4 P56524 1/20 0.32
EDNRB P24530 1/20 0.30
EDNRA P25101 1/20 0.30
FAAH O00519 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HSP90AA1 P07900 1/20 0.30
PKM P14618 1/20 0.30
HTT P42858 1/20 0.30
MGLL Q99685 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
SCHEMBL16900935 0.98 ATM (0.36) ATMKDM4EL3MBTL1FAAHALDH1A1
SCHEMBL16901033 0.96 ATM (0.38) ATMKDM4EL3MBTL1FAAHALDH1A1
SCHEMBL17012686 0.96 ATM (0.39) ATMKDM4EL3MBTL1HDAC4EDNRB
SCHEMBL17178952 0.96 ATM (0.33) ATMKDM4EL3MBTL1FAAHALDH1A1
SCHEMBL21923270 0.95 ATM (0.38) ATMKDM4EL3MBTL1HDAC4EDNRB
SCHEMBL21923269 0.94 ATM (0.36) ATMKDM4EL3MBTL1HDAC4EDNRB
SCHEMBL17178958 0.94 KDM4E (0.35) ATMKDM4EL3MBTL1
SCHEMBL26196489 0.94 ATM (0.38) ATMKDM4EL3MBTL1EDNRBEDNRA
SCHEMBL26744566 0.93 ATM (0.35) ATMKDM4EL3MBTL1FAAHALDH1A1
SCHEMBL24163254 0.93 KDM4E (0.37) ATMKDM4EL3MBTL1HDAC4

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-2024111958-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE AND ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE 삼성에스디아이 주식회사 2024-05-30 WO disclosed