SCHEMBL8772882

SCHEMBL8772882

CCCCCCCCCC(CC(=O)NO)NC(=O)CC(CC(C)C)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BIRC2 Q13490 5/20 0.52
PLA2G10 O15496 3/20 0.50
MME P08473 1/20 0.48
MMP2 P08253 9/20 0.45
MMP3 P08254 7/20 0.45
MMP1 P03956 6/20 0.45
MMP9 P14780 4/20 0.45
MMP7 P09237 3/20 0.45
PLA2G2C Q5R387 1/20 0.44
MMP14 P50281 1/20 0.43
MMP8 P22894 1/20 0.42

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
SCHEMBL5597388 0.79 FOLH1 (0.59) BIRC2MMP2MMP3MMP1MMP9
SCHEMBL8269110 0.78 MME (0.61) BIRC2MMEMMP2MMP3MMP1
SCHEMBL19818899 0.74 PLA2G2C (0.54) PLA2G10PLA2G2C
SCHEMBL21141384 0.74 PLA2G2C (0.54) PLA2G10PLA2G2C
SCHEMBL2831336 0.74 GRIK1 (0.68)
SCHEMBL1411995 0.74 GRIK1 (0.68)
SCHEMBL2833540 0.74 GRIK1 (0.68)
SCHEMBL1871699 0.74 GRIK1 (0.68)
SCHEMBL2835497 0.74 GRIK1 (0.68)
SCHEMBL2831405 0.74 GRIK1 (0.68)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0800510-A1 HYDROXAMIC ACID-CONTAINING INHIBITORS OF MATRIX METALLOPROTEASES THE PROCTER & GAMBLE COMPANY (US) 1997-10-15 EP claimed
US-5639746-A INHIBITORS OF METALLOPROTEASE THE PROCTER & GAMBLE COMPANY (US) 1997-06-17 US claimed
WO-1996020918-A1 HYDROXAMIC ACID-CONTAINING INHIBITORS OF MATRIX METALLOPROTEASES THE PROCTER & GAMBLE COMPANY (US) 1996-07-11 WO claimed
US-5639746-A INHIBITORS OF METALLOPROTEASE THE PROCTER & GAMBLE COMPANY (US) 1997-06-17 US disclosed