SCHEMBL8970839

SCHEMBL8970839

COC1CCN(CCCCC=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 6/20 0.35
GNAI3 P08754 2/20 0.35
GNAO1 P09471 2/20 0.35
GNAI1 P63096 2/20 0.35
HRH3 Q9Y5N1 1/20 0.34
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
KCNQ3 O43525 1/20 0.33
KCNQ2 O43526 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
TSHR P16473 1/20 0.32
PRKAB2 O43741 1/20 0.32
PRKAG1 P54619 1/20 0.32
PRKAA2 P54646 1/20 0.32
PRKAA1 Q13131 1/20 0.32
PRKAG3 Q9UGI9 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
SCHEMBL2552557 0.87 LMNA (0.35) HRH3LMNAKCNQ3KCNQ2
SCHEMBL4023156 0.80 GNAI3 (0.38) BCHEGNAI3GNAO1GNAI1HRH3
SCHEMBL8971073 0.80 SIGMAR1 (0.46) HRH3LMNAKMT2ACHRM2
SCHEMBL2116384 0.78 HRH3 (0.37) BCHEGNAI3GNAO1GNAI1HRH3
SCHEMBL9815993 0.78 GNAO1 (0.56) GNAI3GNAO1GNAI1CHRM3
SCHEMBL8971344 0.77 KCNA3 (0.38) GNAI3GNAO1GNAI1HRH3
SCHEMBL26745710 0.77 GNAO1 (0.59) GNAI3GNAO1GNAI1
SCHEMBL1463883 0.77 GNAI3 (0.42) GNAI3GNAO1GNAI1CHRM3
SCHEMBL26511089 0.77 GNAO1 (0.59) GNAI3GNAO1GNAI1
SCHEMBL7285791 0.77 GNAI3 (0.55) GNAI3GNAO1GNAI1HRH3TSHR

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-0700383-A1 NOVEL 1-PHENYLALKANONE 5-HT 4? RECEPTOR LIGANDS SYNTEX (U.S.A.) INC. (US) 1996-03-13 EP disclosed