SCHEMBL27452201

SCHEMBL27452201

c1ccc2cc(-n3c4ccc5ccccc5c4c4ccc5c6ccccc6n(-c6cccc7ccccc67)c5c43)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
GSR P00390 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
F2 P00734 1/20 0.33
F10 P00742 1/20 0.33
PRSS1 P07477 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 5/20 0.32
RAB9A P51151 2/20 0.32
POLB P06746 2/20 0.32
PMM2 O15305 1/20 0.32
MPI P34949 1/20 0.32
PHOSPHO1 Q8TCT1 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
NPC1 O15118 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL23233764 0.93 TDP1 (0.42) TDP1GSRCNR1CNR2F2
SCHEMBL23203840 0.91 TDP1 (0.37) TDP1GSRCNR1CNR2F2
SCHEMBL17989799 0.91 KDM4E (0.44) F2F10PRSS1KDM4EATM
SCHEMBL23233715 0.90 TDP1 (0.38) TDP1GSRCNR1CNR2F2
SCHEMBL2606543 0.89 TDP1 (0.45) TDP1GSRCNR1CNR2KDM4E
SCHEMBL17245476 0.88 ATM (0.46) TDP1GSRCNR1CNR2KDM4E
SCHEMBL26154787 0.86 ATM (0.36) TDP1GSRCNR1CNR2KDM4E
SCHEMBL26154789 0.86 KDM4E (0.44) TDP1KDM4EATML3MBTL1ALDH1A1
SCHEMBL21709203 0.85 MAPK10 (0.32) TDP1F2F10PRSS1POLB
SCHEMBL10027551 0.85 KDM4E (0.44) TDP1F2F10PRSS1KDM4E

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-2024143905-A1 ORGANIC ELECTRIC ELEMENT USING ORGANIC ELECTRIC ELEMENT COMPOUND, AND ELECTRONIC DEVICE 덕산네오룩스 주식회사 2024-07-04 WO disclosed