SCHEMBL904913

SCHEMBL904913

N#CC(CCCN1CCC(c2nc3ccccc3[nH]2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.56
KCNA3 P22001 4/20 0.55
HTR2B P41595 1/20 0.53
CCR1 P32246 4/20 0.47
CHRNA7 P36544 1/20 0.47
AKT1 P31749 1/20 0.46

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
SCHEMBL7497972 0.94 KCNA3 (0.63) CCR3KCNA3HTR2BCHRNA7AKT1
SCHEMBL7533221 0.80 HTR2B (0.60) HTR2BCHRNA7
SCHEMBL7470794 0.79 KCNA3 (0.85) CCR3KCNA3CCR1
SCHEMBL17888859 0.78 HTR2B (0.60) HTR2BCHRNA7
SCHEMBL904841 0.78 CCR3 (0.56) CCR3KCNA3CCR1
SCHEMBL904843 0.78 CCR3 (0.56) CCR3KCNA3CCR1
SCHEMBL904837 0.76 ADRA1D (0.62) CCR3KCNA3
SCHEMBL9103936 0.75 KCNA3 (0.85) CCR3KCNA3CCR1
SCHEMBL17888861 0.75 HTR2B (0.62) HTR2BCHRNA7
SCHEMBL904833 0.74 CCR3 (0.57) CCR3KCNA3CCR1

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
WO-2011143444-A2 DIPHENYLBUTYPIPERIDINE AUTOPHAGY INDUCERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-11-17 WO disclosed