SCHEMBL4331923

SCHEMBL4331923

N=C(N)NCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)C(=O)CCl

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 11/20 0.44
▸ NPY1R P25929 6/20 0.44
▸ NPY2R P49146 4/20 0.44
▸ NPY5R Q15761 4/20 0.44
▸ FOLH1 Q04609 1/20 0.41
▸ GNAI3 P08754 1/20 0.37
▸ GNAO1 P09471 1/20 0.37
▸ GNAI1 P63096 1/20 0.37
▸ SIRT5 Q9NXA8 1/20 0.37
▸ NMT2 O60551 2/20 0.36
▸ NMT1 P30419 2/20 0.36
▸ DPP8 Q6V1X1 1/20 0.35
▸ DPP9 Q86TI2 1/20 0.35
▸ DPP7 Q9UHL4 1/20 0.35

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
SCHEMBL2407969 0.92 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5RGNAI3
SCHEMBL30423428 0.89 FOLH1 (0.54) NPY4RNPY1RNPY2RNPY5RFOLH1
SCHEMBL31171160 0.89 FOLH1 (0.54) NPY4RNPY1RNPY2RNPY5RFOLH1
SCHEMBL30045741 0.89 FOLH1 (0.54) NPY4RNPY1RNPY2RNPY5RFOLH1
SCHEMBL31452998 0.89 FOLH1 (0.54) NPY4RNPY1RNPY2RNPY5RFOLH1
SCHEMBL30414248 0.89 FOLH1 (0.54) NPY4RNPY1RNPY2RNPY5RFOLH1
SCHEMBL29902836 0.89 FOLH1 (0.54) NPY4RNPY1RNPY2RNPY5RFOLH1
SCHEMBL4595320 0.89 FOLH1 (0.54) NPY4RNPY1RNPY2RNPY5RFOLH1
SCHEMBL31420018 0.89 FOLH1 (0.54) NPY4RNPY1RNPY2RNPY5RFOLH1
SCHEMBL27613292 0.89 FOLH1 (0.54) NPY4RNPY1RNPY2RNPY5RFOLH1

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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