SCHEMBL4331936

SCHEMBL4331936

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

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 16/20 0.38
▸ NPY1R P25929 10/20 0.38
▸ NPY5R Q15761 9/20 0.38
▸ NPY2R P49146 6/20 0.38
▸ DPP4 P27487 1/20 0.32
▸ DPP8 Q6V1X1 1/20 0.32
▸ DPP9 Q86TI2 1/20 0.32
▸ DPP7 Q9UHL4 1/20 0.32

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
SCHEMBL30644785 0.87 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2R
SCHEMBL9614927 0.85 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2R
SCHEMBL15011349 0.85 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2R
SCHEMBL27732271 0.85 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2R
SCHEMBL12655761 0.84 NPY4R (0.40) NPY4RNPY1RNPY5RNPY2RDPP7
SCHEMBL27335224 0.83 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2R
SCHEMBL27335222 0.83 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30111320 0.83 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2R
SCHEMBL6680407 0.83 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2RDPP4
SCHEMBL31265334 0.81 NPY4R (0.41) NPY4RNPY1RNPY5RNPY2R

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-2009143584-A1 TREATMENT OF PULMONARY EDEMA VEGENICS LIMITED (AU) 2009-12-03 — — WO disclosed
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