SCHEMBL17147113

SCHEMBL17147113

CNC(=O)[C@@H](NC(=O)CN(C)C=O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.34
MMP9 P14780 1/20 0.34
MMP14 P50281 1/20 0.34
CNR2 P34972 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
SCHEMBL30455965 0.83 MMP1 (0.39) MMP1MMP9MMP14CNR2
SCHEMBL12855343 0.77 ADAM17 (0.32) MMP1MMP9
SCHEMBL17752523 0.75
SCHEMBL21348163 0.75
SCHEMBL13451426 0.74
SCHEMBL16360269 0.73 CYP2C9 (0.42) MMP1MMP9MMP14
SCHEMBL17919955 0.69 MMP1 (0.39) MMP1MMP9MMP14
SCHEMBL22522386 0.69 PDF (0.34)
SCHEMBL13888697 0.69 ALDH1A1 (0.36) MMP1MMP9MMP14CNR2
SCHEMBL26007862 0.68 MMP1 (0.35) MMP1MMP9MMP14

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-2927227-A1 ANTIBODY-LINKER-DRUG CONJUGATE, PREPARATION METHOD THEREFOR, AND ANTICANCER DRUG COMPOSITION CONTAINING SAME Celltrion, Inc. (KR) 2015-10-07 EP disclosed