SCHEMBL6184052

SCHEMBL6184052

CC1CCCCN1C(=O)[C@@H]1CCCN(C2CCN(C(=O)c3c4ccccc4cc4ccccc34)CC2)C1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACACB O00763 14/20 0.68
ACACA Q13085 14/20 0.68
KDM2B Q8NHM5 5/20 0.46
MBTD1 Q05BQ5 1/20 0.45
TP53BP1 Q12888 1/20 0.45
L3MBTL3 Q96JM7 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL6182718 0.88 ACACB (0.67) ACACBACACAKDM2B
SCHEMBL6181808 0.87 ACACB (0.69) ACACBACACAKDM2B
SCHEMBL6183505 0.87 ACACB (0.84) ACACBACACAKDM2BMBTD1TP53BP1
SCHEMBL6181556 0.86 ACACB (0.80) ACACBACACAKDM2B
SCHEMBL976349 0.86 ACACB (0.83) ACACBACACAKDM2BMBTD1TP53BP1
SCHEMBL2622325 0.86 ACACB (0.83) ACACBACACAKDM2BMBTD1TP53BP1
SCHEMBL6181941 0.85 ACACB (0.64) ACACBACACAKDM2BMBTD1TP53BP1
SCHEMBL6184131 0.85 ACACB (0.68) ACACBACACAKDM2B
SCHEMBL6186949 0.84 ACACB (0.77) ACACBACACAKDM2B
SCHEMBL6184582 0.84 ACACB (0.62) ACACBACACAKDM2BL3MBTL1

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
US-6979741-B2 Acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2005-12-27 US disclosed
EP-1478437-B1 ACC INHIBITORS PFIZER PROD INC (US) 2005-08-31 EP disclosed