SCHEMBL29358366

SCHEMBL29358366

CN1CCCC1CNC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.44
CHRNA5 P30532 1/20 0.44
CHRNA7 P36544 1/20 0.44
CHRNA4 P43681 1/20 0.44
ALDH1A1 P00352 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
CTSK P43235 1/20 0.41
OPRM1 P35372 1/20 0.40
KAT2B Q92831 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2D6 P10635 1/20 0.40
MALT1 Q9UDY8 1/20 0.39
CHRM3 P20309 1/20 0.39

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
SCHEMBL11240147 0.87 OPRM1 (0.46) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1
SCHEMBL12506716 0.85 FAP (0.44) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1
SCHEMBL8320704 0.85 FAP (0.44) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1
SCHEMBL15934293 0.82 MTNR1A (0.46) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1
SCHEMBL21661030 0.82 MTNR1A (0.46) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1
SCHEMBL6395379 0.82 ACKR3 (0.51) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1
SCHEMBL8050286 0.82 MTNR1A (0.46) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1
SCHEMBL28645032 0.82 DRD2 (0.43) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1
SCHEMBL28649804 0.82 CHRNB2 (0.43) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1
SCHEMBL23866583 0.81 DPP4 (0.48) CHRNB2CHRNA5CHRNA7CHRNA4ALDH1A1

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-3941903-A1 NOVEL POTASSIUM CHANNEL INHIBITORS Saniona A/S (DK) 2022-01-26 EP disclosed