SCHEMBL14979149

SCHEMBL14979149

CC#CCN1CCC(N(C)C)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
L3MBTL3 Q96JM7 1/20 0.33
CHRM2 P08172 6/20 0.33
CHRM4 P08173 6/20 0.33
CHRM5 P08912 6/20 0.33
CHRM1 P11229 6/20 0.33
CHRM3 P20309 6/20 0.33
NPY1R P25929 1/20 0.31
HRH2 P25021 1/20 0.31
HRH1 P35367 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
BCHE P06276 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
SCHEMBL16803631 0.89 HRH3 (0.37) HRH2HRH1HRH3
SCHEMBL12376552 0.79 HTT (0.33) LMNAL3MBTL3CHRM2CHRM4CHRM5
SCHEMBL12376563 0.79 CHRM2 (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL20649067 0.78 LMNA (0.34) LMNAL3MBTL3CHRM2CHRM4CHRM5
SCHEMBL2284333 0.78 BCHE (0.47) BCHE
SCHEMBL7282316 0.78 L3MBTL3 (0.38) L3MBTL3CHRM2CHRM4CHRM5CHRM1
SCHEMBL1308650 0.78 HRH3 (0.37) L3MBTL3NPY1RHRH2HRH1HRH3
SCHEMBL21941322 0.77 LMNA (0.39) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL16803633 0.77 ACHE (0.42) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL17108654 0.72 LMNA (0.34) LMNACHRM2CHRM4CHRM5CHRM1

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
US-8450315-B2 Phosphoinositide 3-kinase inhibitor compounds and methods of use GENENTECH, INC. (US) 2013-05-28 US disclosed