SCHEMBL23850165

SCHEMBL23850165

CCOC(=O)c1cccn1CCCC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
GLA P06280 1/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.42
TNF P01375 1/20 0.42
EPHX2 P34913 7/20 0.42
CNR2 P34972 2/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
TSHR P16473 1/20 0.40
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 2/20 0.40

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
SCHEMBL23850522 0.96 MEN1 (0.45) MEN1GLAKMT2ANPSR1TNF
SCHEMBL29903004 0.89 CNR2 (0.43) MEN1GLAKMT2ATNFEPHX2
SCHEMBL23852583 0.89 TNF (0.54) TNFEPHX2CNR2GAA
SCHEMBL29225350 0.87 EPHX2 (0.44) EPHX2CNR2KDM4EMAPTTSHR
SCHEMBL23852674 0.84 TNF (0.50) TNFEPHX2CNR2ALDH1A1
SCHEMBL3024871 0.84 EPHX2 (0.42) TNFEPHX2CNR2KDM4EMAPT
SCHEMBL30829444 0.83 TSHR (0.46) EPHX2KDM4EMAPTTSHRRAB9A
SCHEMBL29225365 0.83 TSHR (0.46) EPHX2KDM4EMAPTTSHRNPC1
SCHEMBL3016395 0.81 EPHX2 (0.44) EPHX2KDM4EMAPTTSHRNPC1
SCHEMBL13541632 0.80 TSHR (0.48) EPHX2MAPTTSHRSMN1; SMN2GAA

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
EP-3883931-A1 HETEROCYCLIC COMPOUNDS AND MEDICAL USE THEREOF Fondazione Telethon (IT) 2021-09-29 EP disclosed