SCHEMBL11347759

SCHEMBL11347759

CC(=O)SCC(CC(C)C)C(=O)CCCCCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 10/20 0.46
NPY5R Q15761 6/20 0.46
NPY1R P25929 5/20 0.46
NPY2R P49146 3/20 0.46
NOD1 Q9Y239 6/20 0.41
FNTA P49354 2/20 0.39
FNTB P49356 2/20 0.39
PGGT1B P53609 1/20 0.38

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
SCHEMBL11352509 0.91 NPY4R (0.47) NPY4RNPY5RNPY1RNPY2RNOD1
SCHEMBL11207356 0.90 NPY4R (0.46) NPY4RNPY5RNPY1RNPY2RNOD1
SCHEMBL9069166 0.87 NPY4R (0.43) NPY4RNPY5RNPY1RNPY2RNOD1
SCHEMBL9068526 0.84 NPY4R (0.40) NPY4RNPY5RNPY1RNPY2R
SCHEMBL10919416 0.83 NPY4R (0.39) NPY4RNPY5RNPY1RNPY2R
SCHEMBL9068939 0.81 NPY4R (0.43) NPY4RNPY5RNPY1RNPY2R
SCHEMBL11349966 0.80 NPY4R (0.41) NPY4RNPY5RNPY1RNPY2RNOD1
SCHEMBL2344242 0.80 NOD1 (0.52) NPY4RNPY5RNPY1RNPY2RNOD1
SCHEMBL10918462 0.80 NPY4R (0.44) NPY4RNPY5RNPY1RNPY2R
SCHEMBL11210708 0.79 FNTA (0.53) NPY4RNPY5RNPY1RNPY2RNOD1

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
US-4297275-A Inhibitors of mammalian collagenase E. R. SQUIBB & SONS, INC. (US) 1981-10-27 US claimed
EP-0021766-A2 Inhibitors of mammalian collagenase E.R. Squibb & Sons, Inc. (US) 1981-01-07 EP claimed
US-4235885-A Inhibitors of mammalian collagenase E. R. SQUIBB & SONS, INC. (US) 1980-11-25 US claimed
US-4297275-A Inhibitors of mammalian collagenase E. R. SQUIBB & SONS, INC. (US) 1981-10-27 US disclosed
EP-0021766-A2 Inhibitors of mammalian collagenase E.R. Squibb & Sons, Inc. (US) 1981-01-07 EP disclosed
US-4235885-A Inhibitors of mammalian collagenase E. R. SQUIBB & SONS, INC. (US) 1980-11-25 US disclosed