SCHEMBL904833

SCHEMBL904833

N#CC(CCCN1CCC(n2nnc3ccccc32)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 3/20 0.57
KCNA3 P22001 4/20 0.51
USP2 O75604 1/20 0.48
GAA P10253 1/20 0.48
CCR1 P32246 8/20 0.48
HTR2A P28223 1/20 0.46
HTR7 P34969 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
SCHEMBL904860 0.81 CCR3 (0.57) CCR3KCNA3CCR1
SCHEMBL904859 0.81 DRD2 (0.58) CCR3KCNA3CCR1
SCHEMBL27589107 0.77 USP2 (0.65) CCR3USP2GAAHTR2AHTR7
SCHEMBL5729319 0.76 HTR2A (0.53) USP2GAAHTR2AHTR7
SCHEMBL9103936 0.76 KCNA3 (0.85) CCR3KCNA3CCR1
SCHEMBL904831 0.76 CCR3 (0.64) CCR3KCNA3CCR1
SCHEMBL7470794 0.75 KCNA3 (0.85) CCR3KCNA3CCR1
SCHEMBL5858628 0.74 DRD2 (0.61) CCR3KCNA3CCR1
SCHEMBL904913 0.74 CCR3 (0.56) CCR3KCNA3CCR1
SCHEMBL904853 0.73 CCR3 (0.55) CCR3KCNA3CCR1HTR2AHTR7

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