SCHEMBL27407152

SCHEMBL27407152

C1=Cc2c(n(-c3cccc(-c4ccccc4)c3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc(-c6ccc(-c7cccc(-c8cccc(-c9ccc(-c%10cccc(-c%11ccccc%11)c%10)cc9)c8)c7)cc6)cc5)cc4)cc23)CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TSPO P30536 1/20 0.32
HDAC4 P56524 1/20 0.32
FAAH O00519 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSP90AA1 P07900 1/20 0.31
PKM P14618 1/20 0.31
HTT P42858 1/20 0.31
MGLL Q99685 1/20 0.31
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
KMT2A Q03164 1/20 0.30
IL1R1 P14778 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
SCHEMBL20275275 1.00 ATM (0.38) ATMKDM4EL3MBTL1TSPOHDAC4
SCHEMBL24054616 0.99 ATM (0.39) ATMKDM4EL3MBTL1TSPOHDAC4
SCHEMBL24130622 0.99 ATM (0.39) ATMKDM4EL3MBTL1TSPOHDAC4
SCHEMBL25073481 0.99 ATM (0.39) ATMKDM4EL3MBTL1TSPOHDAC4
SCHEMBL25509504 0.98 ATM (0.40) ATMKDM4EL3MBTL1TSPOHDAC4
SCHEMBL27447332 0.98 ATM (0.40) ATMKDM4EL3MBTL1TSPOHDAC4
SCHEMBL25925768 0.97 L3MBTL1 (0.39) ATMKDM4EL3MBTL1TSPOHDAC4
SCHEMBL14220693 0.97 ATM (0.39) ATMKDM4EL3MBTL1TSPOHDAC4
SCHEMBL16901103 0.97 ATM (0.38) ATMKDM4EL3MBTL1TSPOFAAH
SCHEMBL25073718 0.96 ATM (0.35) ATMKDM4EL3MBTL1TSPOFAAH

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-2024117109-A1 COMPOSITION FOR FORMING LIGHT EMITTING LAYER OF ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT AND METHOD FOR PRODUCING SAME, AND DISPLAY DEVICE 三菱ケミカル株式会社 2024-06-06 WO disclosed