SCHEMBL7408183

SCHEMBL7408183

CC(C)C[C@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.66
MMP1 P03956 9/20 0.66
MMP9 P14780 7/20 0.66
MMP3 P08254 6/20 0.66
MMP8 P22894 5/20 0.66
MMP7 P09237 3/20 0.66
FCER2 P06734 3/20 0.66
MMP12 P39900 1/20 0.62
MMP13 P45452 1/20 0.62

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
SCHEMBL5099222 0.90 MMP2 (0.80) MMP2MMP1MMP9MMP3MMP8
SCHEMBL6804766 0.82 MMP9 (0.64) MMP2MMP1MMP9MMP3MMP8
SCHEMBL11119167 0.80 MME (0.76) MMP2MMP9MMP7MMP12MMP13
SCHEMBL11122734 0.80 MME (0.76) MMP2MMP9MMP7MMP12MMP13
SCHEMBL11122302 0.80 MME (0.76) MMP2MMP9MMP7MMP12MMP13
SCHEMBL11119164 0.80 MME (0.76) MMP2MMP9MMP7MMP12MMP13
SCHEMBL11122736 0.80 MME (0.76) MMP2MMP9MMP7MMP12MMP13
SCHEMBL5502507 0.80 MMP2 (1.00) MMP2MMP1MMP9MMP3MMP8
SCHEMBL7764932 0.79 CYP3A4 (0.64) MMP2MMP1MMP9MMP3MMP8
SCHEMBL5556662 0.78 MMP2 (0.81) MMP2MMP1MMP9MMP3MMP8

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0642486-B1 PRODUCTION OF HYDROFLUOROCARBONS FROM alpha-FLUOROETHERS AND SOME alpha-FLUOROETHERS ICI PLC (GB) 1999-06-02 EP disclosed
US-5750807-A REACTION OF ALDEHYDE WITH HYDROGEN FLUORIDE FOR FLUORINATION IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1998-05-12 US disclosed
US-5696308-A HEATING AN ALPHA-FLUOROETHER IN THE VAPOR PHASE WITH HYDROGEN FLUORIDE IN THE PRESENCE OF A CATALYST IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1997-12-09 US disclosed
US-5637776-A ACYCLIC FLUORINATED ETHER IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1997-06-10 US disclosed
EP-0740652-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-11-06 EP disclosed
US-5504263-A HEATING ALPHA-FLUOROETHER IN VAPOR PHASE AT ELEVATED TEMPERATURE INPRESENCE OF HYDROGEN FLUORIDE AND CATALYST IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1996-04-02 US disclosed
WO-1995019956-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-07-27 WO disclosed
EP-0642486-A1 PRODUCTION OF HYDROFLUOROCARBONS FROM $g(a)-FLUOROETHERS AND $g(a)-FLUOROETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-03-15 EP disclosed
WO-1993012057-A1 PRODUCTION OF HYDROFLUOROCARBONS FROM α-FLUOROETHERS AND α-FLUOROETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-24 WO disclosed