SCHEMBL6182741

SCHEMBL6182741

CC(C)S(=O)(=O)N1CCN(C(=O)[C@@H]2CCCN(C3CCN(C(=O)c4c5ccccc5cc5ccccc45)CC3)C2)CC1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACACB O00763 15/20 0.69
ACACA Q13085 15/20 0.69
KDM2B Q8NHM5 2/20 0.45
CNR1 P21554 1/20 0.43
MAPK1 P28482 1/20 0.42
PARP1 P09874 1/20 0.42

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
SCHEMBL6183510 0.88 ACACB (0.69) ACACBACACAKDM2BCNR1MAPK1
SCHEMBL6183505 0.86 ACACB (0.84) ACACBACACAKDM2B
SCHEMBL978699 0.85 ACACB (0.74) ACACBACACAKDM2B
SCHEMBL6181556 0.85 ACACB (0.80) ACACBACACAKDM2B
SCHEMBL2622325 0.85 ACACB (0.83) ACACBACACAKDM2B
SCHEMBL976349 0.85 ACACB (0.83) ACACBACACAKDM2B
SCHEMBL6185174 0.84 ACACB (0.78) ACACBACACAKDM2B
SCHEMBL6184986 0.83 ACACB (0.77) ACACBACACAKDM2B
SCHEMBL2622329 0.82 ACACB (0.77) ACACBACACAKDM2B
SCHEMBL6491415 0.82 ACACB (0.78) ACACBACACAKDM2B

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