SCHEMBL6183908

SCHEMBL6183908

CCOC(=O)C1CCCN(C2CCN(C(=O)c3cc(-c4ccccc4)nc(-c4ccccc4)c3)CC2)C1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACACB O00763 15/20 0.61
ACACA Q13085 15/20 0.61
KDM4E B2RXH2 2/20 0.56
GAA P10253 1/20 0.56
MAPK1 P28482 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56

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
SCHEMBL6185100 1.00 ACACB (0.61) ACACBACACAKDM4EGAAMAPK1
SCHEMBL6181851 0.91 KDM4E (0.54) ACACBACACAKDM4EGAAMAPK1
SCHEMBL6182735 0.91 KDM4E (0.54) ACACBACACAKDM4EGAAMAPK1
SCHEMBL6181391 0.87 ACACB (0.65) ACACBACACA
SCHEMBL6184570 0.85 ACACB (0.63) ACACBACACA
SCHEMBL6184710 0.85 ACACB (0.66) ACACBACACA
SCHEMBL6184047 0.85 ACACB (0.62) ACACBACACA
SCHEMBL6182331 0.83 ACACB (0.60) ACACBACACA
SCHEMBL6185802 0.83 ACACB (0.81) ACACBACACA
SCHEMBL6184997 0.83 ACACB (0.69) ACACBACACA

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-1478437-B1 ACC INHIBITORS PFIZER PROD INC (US) 2005-08-31 EP disclosed