SCHEMBL7679060

SCHEMBL7679060

CN(C)CCC1(CCO)c2ccccc2CCc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.57
CYP2D6 P10635 4/20 0.51
SLC6A4 P31645 6/20 0.39
MAPT P10636 4/20 0.39
SLC6A2 P23975 4/20 0.39
CACNA1B Q00975 4/20 0.39
ALDH1A1 P00352 3/20 0.39
SLC22A1 O15245 3/20 0.39
CHRM2 P08172 3/20 0.39
CHRM4 P08173 3/20 0.39
HTR1A P08908 3/20 0.39
CHRM5 P08912 3/20 0.39
ADORA3 P0DMS8 3/20 0.39
CHRM1 P11229 3/20 0.39
DRD2 P14416 3/20 0.39
ADRA2B P18089 3/20 0.39
ADRA2C P18825 3/20 0.39
CHRM3 P20309 3/20 0.39
DRD1 P21728 3/20 0.39
HRH2 P25021 3/20 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
SCHEMBL8507603 0.77 LMNA (0.64) LMNACYP2D6SLC6A4MAPTSLC6A2
SCHEMBL8505464 0.73 LMNA (0.44) LMNACYP2D6SIGMAR1KDM4ESMN1; SMN2
SCHEMBL11252431 0.73 LMNA (1.00) LMNACYP2D6SLC6A4MAPTSLC6A2
SCHEMBL7681700 0.73 LMNA (0.48) LMNACYP2D6SLC6A4MAPTSLC6A2
SCHEMBL25066219 0.72 LMNA (0.91) LMNACYP2D6SLC6A4MAPTSLC6A2
SCHEMBL7675371 0.72 LMNA (0.54) LMNACYP2D6SLC6A4MAPTSLC6A2
SCHEMBL7675246 0.72 LMNA (0.54) LMNACYP2D6SLC6A4MAPTSLC6A2
SCHEMBL8504242 0.71 LMNA (0.49) LMNACYP2D6SLC6A4MAPTSLC6A2
SCHEMBL4178165 0.71 LMNA (0.52) LMNACYP2D6SLC6A4MAPTSLC6A2
SCHEMBL8253828 0.71 LMNA (0.60) LMNACYP2D6CHRM2CHRM4CHRM5

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-6387893-B1 ADRENERGIC BLOCKING AGENT; BENIGN PROSATATIC HYPERPLASIA MERCK & CO., INC. 2002-05-14 US disclosed