SCHEMBL15813401

SCHEMBL15813401

CNC(=O)[C@H](Cc1ccccc1)N(O)C(=O)[C@H](CC(C)C)[C@H](CSc1cccs1)C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 10/20 0.61
FCER2 P06734 15/20 0.60
MMP2 P08253 5/20 0.59
MMP9 P14780 4/20 0.59
MMP3 P08254 2/20 0.59
MMP7 P09237 2/20 0.59
MMP8 P22894 2/20 0.59
MMP13 P45452 2/20 0.59
MMP14 P50281 2/20 0.59
ADAM17 P78536 2/20 0.59

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
SCHEMBL3498528 1.00 MMP1 (0.61) MMP1FCER2MMP2MMP9MMP3
SCHEMBL23258231 0.84 MMP1 (0.86) MMP1FCER2MMP2MMP9MMP3
SCHEMBL4986992 0.81 FCER2 (0.73) MMP1FCER2MMP2MMP9MMP3
SCHEMBL7120973 0.77 MMP1 (0.60) MMP1FCER2MMP2MMP9MMP3
SCHEMBL22847464 0.77 MMP1 (0.91) MMP1FCER2MMP2MMP9MMP3
Batimastat SCHEMBL22803645 0.75 MMP1 (1.00) MMP1FCER2MMP2MMP9MMP3
Batimastat SCHEMBL20793035 0.75 MMP1 (1.00) MMP1FCER2MMP2MMP9MMP3
Batimastat SCHEMBL10052355 0.75 MMP1 (1.00) MMP1FCER2MMP2MMP9MMP3
Batimastat SCHEMBL12561510 0.75 MMP1 (1.00) MMP1FCER2MMP2MMP9MMP3
Batimastat SCHEMBL4333 0.75 MMP1 (1.00) MMP1FCER2MMP2MMP9MMP3

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-20140178293-A1 METHODS FOR IMAGING BONE PRECURSOR CELLS USING DUAL-LABELED IMAGING AGENTS TO DETECT MMP-9 POSITIVE CELLS BAYLOR COLLEGE OF MEDICINE (US) 2014-06-26 US disclosed