SCHEMBL7601741

SCHEMBL7601741

COC(=O)C(O)N1CC(C)(C)C(C(C)C)N(C(O)C(=O)OC)C1=O

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30

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
SCHEMBL7566446 0.75 MMP1 (0.33) MMP1MMP2MMP9
SCHEMBL7603792 0.66 THRB (0.39)
SCHEMBL7573611 0.58 MEN1 (0.31)
SCHEMBL11001343 0.57 BRD4 (0.35)
SCHEMBL18099898 0.57 MMP2 (0.45) MMP1MMP2MMP9
SCHEMBL11361947 0.56 PHGDH (0.36)
SCHEMBL5180606 0.55 THRB (0.45)
SCHEMBL9939423 0.55
SCHEMBL8552454 0.55 PHGDH (0.38)
SCHEMBL22796250 0.54 CYP1A2 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976738-B1 Process for the preparation of propylene ureas DAINIPPON INK & CHEMICALS (JP) 2002-12-04 EP disclosed
US-6348594-B2 HARDENING OF POLYMERS DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-02-19 US disclosed
EP-0976738-A2 Propylene ureas and the process for their preparation DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-02-02 EP disclosed