SCHEMBL8971215

SCHEMBL8971215

CCCCCN1CCC(CC(C)=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 7/20 0.50
GNAI3 P08754 6/20 0.50
GNAI1 P63096 6/20 0.50
KCNH2 Q12809 2/20 0.48
BCHE P06276 4/20 0.46
EPHX1 P07099 1/20 0.43
EPHX2 P34913 1/20 0.43

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
SCHEMBL8971210 0.87 EPHX1 (0.44) GNAO1GNAI3GNAI1EPHX1EPHX2
SCHEMBL23533551 0.86 KCNH2 (0.51) GNAO1GNAI3GNAI1KCNH2BCHE
Hydrochloric Acid SCHEMBL29966132 0.85 GNAO1 (0.53) GNAO1GNAI3GNAI1KCNH2BCHE
Acetic Acid SCHEMBL30330029 0.83 KCNH2 (0.51) GNAO1GNAI3GNAI1KCNH2BCHE
Acetic Acid SCHEMBL29252423 0.81 KCNH2 (0.54) GNAO1GNAI3GNAI1KCNH2BCHE
Acetic Acid SCHEMBL30330365 0.81 KCNH2 (0.54) GNAO1GNAI3GNAI1KCNH2BCHE
Acetic Acid SCHEMBL30330974 0.81 KCNH2 (0.54) GNAO1GNAI3GNAI1KCNH2BCHE
Acetic Acid SCHEMBL30329903 0.81 KCNH2 (0.54) GNAO1GNAI3GNAI1KCNH2BCHE
Acetic Acid SCHEMBL29252369 0.81 KCNH2 (0.54) GNAO1GNAI3GNAI1KCNH2BCHE
SCHEMBL7327464 0.81 EPHX1 (0.47) GNAO1GNAI3GNAI1KCNH2EPHX1

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