SCHEMBL7098147

SCHEMBL7098147

CCCC[C@H](C(=O)NCC(C)C)N(O)C=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.41
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
SLC15A1 P46059 1/20 0.38
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
PDF Q9HBH1 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
CTSK P43235 1/20 0.35
CA1 P00915 2/20 0.34
CA2 P00918 2/20 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
SCHEMBL7095567 0.86 CYP2D6 (0.35) EPHX1CYP2D6CYP2C19
SCHEMBL7097230 0.83 CYP2D6 (0.41) EPHX1CNR1CNR2CYP2D6CYP2C19
SCHEMBL7094366 0.81 MAPT (0.40) EPHX1DPP7
SCHEMBL7277162 0.74 EPHX1 (0.50) EPHX1CNR1CNR2SLC15A1CYP2D6
SCHEMBL5224064 0.71 DPP7 (0.66) EPHX1SLC15A1CYP2D6CYP2C19DPP7
SCHEMBL27789284 0.71 DPP7 (0.66) EPHX1SLC15A1CYP2D6CYP2C19DPP7
Hydrochloric Acid SCHEMBL4824669 0.70 DPP7 (0.64) EPHX1SLC15A1CYP2D6CYP2C19DPP7
SCHEMBL23430580 0.68 EPHX1 (0.56) EPHX1CNR1CNR2CYP2D6CYP2C19
SCHEMBL7294011 0.68 EPHX1 (0.56) EPHX1CNR1CNR2CYP2D6CYP2C19
SCHEMBL5675727 0.68 ANPEP (0.53) EPHX1CNR1CNR2SLC15A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0815084-B1 LACTAM-CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEASE PROCTER & GAMBLE (US) 2003-08-27 EP claimed
EP-0815084-A1 LACTAM-CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEASE THE PROCTER & GAMBLE COMPANY (US) 1998-01-07 EP claimed
US-5672598-A MATRIX METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1997-09-30 US claimed
WO-1996029313-A1 LACTAM-CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEASE THE PROCTER & GAMBLE COMPANY (US) 1996-09-26 WO claimed
EP-0815084-B1 LACTAM-CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MATRIX METALLOPROTEASE PROCTER & GAMBLE (US) 2003-08-27 EP disclosed
US-5672598-A MATRIX METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1997-09-30 US disclosed