SCHEMBL28195728

SCHEMBL28195728

CCC(NC(=O)C(NC)C(C)C)C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ECE1 P42892 3/20 0.40
▸ ENPEP Q07075 10/20 0.36
▸ ACE P12821 2/20 0.34
▸ NOD1 Q9Y239 1/20 0.34
▸ HTT P42858 1/20 0.31

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
SCHEMBL18048549 0.84 MMP2 (0.37) ACE
SCHEMBL18048550 0.84 MMP2 (0.37) ACE
SCHEMBL4254687 0.81 ECE1 (0.38) ECE1ENPEPACENOD1
SCHEMBL23393940 0.80 SIRT5 (0.39) ECE1NOD1
SCHEMBL13594559 0.79 ECE1 (0.36) ECE1ENPEPACENOD1
SCHEMBL25264872 0.79 PDF (0.35) —
SCHEMBL23866603 0.79 ECE1 (0.41) ECE1ENPEPACENOD1
SCHEMBL21661227 0.79 ECE1 (0.41) ECE1ENPEPACENOD1
SCHEMBL22599148 0.78 DPP8 (0.38) —
SCHEMBL24140824 0.77 MME (0.34) —

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
CN-107614010-A It is bound to the antibody drug conjugates (ADC) of FLT3 albumen 艾更斯司股份有限公司 2018-01-19 — — CN claimed
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