SCHEMBL9866747

SCHEMBL9866747

O=C1C[C@H](O)C(CC2CCCCC2)N1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSD P07339 14/20 0.60
IDE P14735 1/20 0.38
MMP1 P03956 4/20 0.34
MMP9 P14780 3/20 0.34
MMP7 P09237 2/20 0.34
MMP3 P08254 1/20 0.34

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
SCHEMBL9866742 1.00 CTSD (0.60) CTSDIDEMMP1MMP9MMP7
SCHEMBL7385411 0.78 CTSD (0.45) CTSDIDEMMP1MMP9MMP7
SCHEMBL8745896 0.75 ITGB1 (0.42) CTSDMMP1MMP9MMP7MMP3
SCHEMBL5963363 0.74 CTSD (0.40) CTSDMMP1MMP9MMP7MMP3
SCHEMBL13969675 0.72
SCHEMBL3743995 0.72
SCHEMBL14069032 0.72
SCHEMBL30934204 0.72 CTSD (0.48) CTSD
SCHEMBL9491181 0.70 CTSD (0.49) CTSDMMP1MMP9MMP7MMP3
SCHEMBL8970758 0.70 CTSD (0.39) CTSD

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-5061808-A 2-oxo-1-pyrrolidine carboxylic acid esters WARNER-LAMBERT COMPANY (US) 1991-10-29 US disclosed
US-4876343-A Process for statine and statine analogs WARNER-LAMBERT COMPANY (US) 1989-10-24 US disclosed