SCHEMBL27447332

SCHEMBL27447332

C1=Cc2c(n(-c3ccccc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5ccccc5)c4)cc23)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TSPO P30536 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HTT P42858 2/20 0.32
FAAH O00519 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PKM P14618 1/20 0.32
MGLL Q99685 1/20 0.32
HDAC4 P56524 1/20 0.31
KMT2A Q03164 2/20 0.31
IL1R1 P14778 1/20 0.31
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
PTGER4 P35408 1/20 0.31
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
WNK1 Q9H4A3 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
SCHEMBL25509504 1.00 ATM (0.40) ATML3MBTL1KDM4ETSPOALDH1A1
SCHEMBL25073481 0.99 ATM (0.39) ATML3MBTL1KDM4ETSPOALDH1A1
SCHEMBL24054616 0.99 ATM (0.39) ATML3MBTL1KDM4ETSPOALDH1A1
SCHEMBL24130622 0.99 ATM (0.39) ATML3MBTL1KDM4ETSPOALDH1A1
SCHEMBL16901103 0.99 ATM (0.38) ATML3MBTL1KDM4ETSPOALDH1A1
SCHEMBL27407152 0.98 ATM (0.38) ATML3MBTL1KDM4ETSPOALDH1A1
SCHEMBL20275275 0.98 ATM (0.38) ATML3MBTL1KDM4ETSPOALDH1A1
SCHEMBL9975410 0.98 L3MBTL1 (0.42) ATML3MBTL1KDM4ETSPOALDH1A1
SCHEMBL25925768 0.97 L3MBTL1 (0.39) ATML3MBTL1KDM4ETSPOALDH1A1
SCHEMBL14220693 0.97 ATM (0.39) ATML3MBTL1KDM4ETSPOALDH1A1

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-2024143996-A1 ORGANIC ELECTRIC ELEMENT USING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2024-07-04 WO disclosed