SCHEMBL8138202

SCHEMBL8138202

CCCC(=O)C1=C(O)CCN(COCC)C1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.32
CHRM4 P08173 3/20 0.32
CHRM5 P08912 3/20 0.32
CHRM1 P11229 3/20 0.32
CHRM3 P20309 3/20 0.32
HRH2 P25021 1/20 0.30
HRH1 P35367 1/20 0.30

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
SCHEMBL9415796 0.68
SCHEMBL22175548 0.66 HSD17B3 (0.39)
SCHEMBL9568939 0.60 CHRNB2 (0.37) HRH2HRH1
SCHEMBL4906908 0.59 ALDH1A1 (0.30)
SCHEMBL48583 0.56
SCHEMBL2497282 0.56
SCHEMBL13155617 0.55 DRD2 (0.39)
SCHEMBL2620018 0.55 MAPT (0.50)
SCHEMBL762817 0.54 KDM4E (0.36)
SCHEMBL2016344 0.54 HRH3 (0.36) CHRM5

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-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed