SCHEMBL7897381

SCHEMBL7897381

CCOC(=O)CN1CCCC(NC(=O)OC(C)(C)C)C1=O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.56
F10 P00742 1/20 0.56
PRSS1 P07477 1/20 0.56
MMP1 P03956 6/20 0.43
MMP3 P08254 6/20 0.43
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
CASP3 P42574 1/20 0.39
GAA P10253 1/20 0.39
HRH4 Q9H3N8 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MAPT P10636 1/20 0.37
MME P08473 1/20 0.37
ACE P12821 1/20 0.37

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
SCHEMBL7897384 1.00 F2 (0.56) F2F10PRSS1MMP1MMP3
SCHEMBL4760675 0.93 F2 (0.48) F2F10PRSS1MMP1MMP3
SCHEMBL12525646 0.86 MMP1 (0.55) F2F10PRSS1MMP1MMP3
SCHEMBL12494289 0.86 MMP1 (0.55) F2F10PRSS1MMP1MMP3
SCHEMBL2707140 0.85 F2 (0.59) F2F10PRSS1MMP1MMP3
SCHEMBL203868 0.85 F2 (0.59) F2F10PRSS1MMP1MMP3
SCHEMBL13259958 0.85 F2 (0.59) F2F10PRSS1MMP1MMP3
SCHEMBL203869 0.85 F2 (0.59) F2F10PRSS1MMP1MMP3
SCHEMBL319693 0.85 F2 (0.56) F2F10PRSS1MMP1MMP3
SCHEMBL319691 0.85 F2 (0.56) F2F10PRSS1MMP1MMP3

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
US-6184207-B1 A PEPTIDE INCLUDING SPECIFIED PIPERIDINE-CONTAINING GROUP, HAVING AN N-TERMINAL HYDROPHOBIC RESIDUE AND OPTIONALLY AN AMIDATED C-TERMINAL OF SPECIFIED END GROUPS; TREATING MULTIPLE SCLEROSIS OR RHEUMATOID ARTHRITIS ZENECA LIMITED (GB) 2001-02-06 US disclosed