SCHEMBL3728026

SCHEMBL3728026

CN1CCN(C(C(=O)O)c2ccc3cocc3c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.37
SLC1A2 P43004 2/20 0.37
SLC1A3 P43003 1/20 0.37
CHRM2 P08172 3/20 0.36
CHRM1 P11229 3/20 0.36
ADRA2A P08913 2/20 0.36
DRD1 P21728 2/20 0.36
DRD3 P35462 2/20 0.36
SLC6A3 Q01959 2/20 0.36
KCNH2 Q12809 2/20 0.36
CYP2D6 P10635 2/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
CHRM3 P20309 1/20 0.36
ADRA1D P25100 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36

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
SCHEMBL13044326 0.83 HPGD (0.50) LMNAGAASLC1A2SLC1A3CHRM2
Hydrochloric Acid SCHEMBL3637935 0.82 LMNA (0.51) LMNAGAASLC1A2SLC1A3CHRM2
SCHEMBL3633025 0.80 AKR1C3 (0.56) LMNAMAPTTSHRTDP1KDM4E
SCHEMBL13044353 0.77 LMNA (0.39) LMNAGAASLC1A2SLC1A3CHRM2
Hydrochloric Acid SCHEMBL3637036 0.76 LMNA (0.41) LMNAGAASLC1A2SLC1A3CHRM2
SCHEMBL3635007 0.76 TP53 (0.55) LMNAGAAMAPTTP53KDM4E
SCHEMBL3635128 0.76 PTGS1 (0.57) LMNAGAAMAPTTSHRTP53
SCHEMBL753845 0.75 LMNA (0.69) LMNAGAASLC1A2SLC1A3CHRM2
SCHEMBL12137582 0.75 LMNA (0.69) LMNAGAASLC1A2SLC1A3CHRM2
Benzene SCHEMBL27817325 0.75 LMNA (0.69) LMNAGAASLC1A2SLC1A3CHRM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167466-A1 N-PHENYL HYDRAZIDES AS MODULATORS OF THE GHRELIN RECEPTOR Glaxo Group Limited (GB) 2010-03-31 EP disclosed
WO-2008148853-A1 N-PHENYL HYDRAZIDES AS MODULATORS OF THE GHRELIN RECEPTOR GLAXO GROUP LIMITED (GB) 2008-12-11 WO disclosed