SCHEMBL8060244

SCHEMBL8060244

COc1cccc(CNC(=O)c2cc(-c3nnn(C[C@H]4CO[C@H](CO)CO4)n3)cc(C)n2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 20/20 1.00
MMP3 P08254 2/20 0.77

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
SCHEMBL8065495 1.00 MMP13 (1.00) MMP13MMP3
SCHEMBL13150364 0.94 MMP13 (0.89) MMP13MMP3
SCHEMBL3751054 0.93 MMP13 (0.87) MMP13MMP3
SCHEMBL3751051 0.93 MMP13 (0.87) MMP13MMP3
SCHEMBL3759995 0.93 MMP13 (0.86) MMP13MMP3
SCHEMBL3648075 0.93 MMP13 (0.86) MMP13MMP3
SCHEMBL3759994 0.93 MMP13 (0.86) MMP13MMP3
SCHEMBL8068289 0.93 MMP13 (0.86) MMP13MMP3
SCHEMBL8070569 0.93 MMP13 (0.86) MMP13MMP3
SCHEMBL8071353 0.92 MMP13 (0.85) MMP13MMP3

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
WO-2009016498-A1 PYRIMIDINE AND PYRIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS PFIZER INC. (US) 2009-02-05 WO disclosed