SCHEMBL28369488

SCHEMBL28369488

CCCCCCCCCCCCn1c2ccccc2c2cccc(CO)c21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 5/20 0.55
PSEN2 P49810 5/20 0.55
APH1B Q8WW43 5/20 0.55
NCSTN Q92542 5/20 0.55
APH1A Q96BI3 5/20 0.55
PSENEN Q9NZ42 5/20 0.55
KDM4E B2RXH2 3/20 0.49
MAPT P10636 1/20 0.49
PGR P06401 1/20 0.49
RORA P35398 1/20 0.49
RORC P51449 1/20 0.49
RORB Q92753 1/20 0.49
CNR2 P34972 8/20 0.48
CNR1 P21554 2/20 0.48
MAPK1 P28482 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAOA P21397 1/20 0.47
ACHE P22303 1/20 0.47

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
SCHEMBL28374675 1.00 PSEN1 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28369297 1.00 PSEN1 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28767719 0.88 ALDH1A1 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17775036 0.85 PGR (0.57) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17775032 0.85 PGR (0.57) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL17775031 0.85 PGR (0.57) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28138993 0.84 KDM4E (0.53) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL15667726 0.83 PGR (0.58) PSEN1PSEN2APH1BNCSTNAPH1A
Benzene SCHEMBL28138961 0.83 KDM4E (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
Benzene SCHEMBL28138954 0.83 KDM4E (0.55) PSEN1PSEN2APH1BNCSTNAPH1A

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
CN-110759852-A Preparation method of 3-hydroxymethyl-9-substituted carbazole 陕西科技大学 2020-02-07 CN disclosed