SCHEMBL18901477

SCHEMBL18901477

CCCOCC(=O)N1CCC[C@H]1C(C)=O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MVD P53602 2/20 0.41
▸ ACE P12821 3/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ACE2 Q9BYF1 1/20 0.36
▸ ALDH1A1 P00352 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
SCHEMBL24242099 0.81 MVD (0.44) MVDACEALDH1A1
SCHEMBL14979028 0.79 ACE (0.45) ACE
SCHEMBL13272263 0.79 ACE (0.45) ACE
SCHEMBL19658296 0.78 ACE (0.44) ACE
SCHEMBL18901653 0.78 DPP4 (0.42) MVDACEL3MBTL1ACE2ALDH1A1
SCHEMBL8097341 0.76 MVD (0.57) MVDACEACE2ALDH1A1
SCHEMBL6786825 0.76 MVD (0.57) MVDACEACE2ALDH1A1
SCHEMBL14623965 0.74 DPP4 (0.54) ACE
SCHEMBL14985781 0.74 DPP4 (0.54) ACE
SCHEMBL19944791 0.74 DPP4 (0.54) ACE

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
EP-2328865-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-05-31 — — EP disclosed
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