SCHEMBL20016348

SCHEMBL20016348

CC(CCOC=O)NC(CCCNC(=N)N)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 9/20 0.32
▸ NPY1R P25929 5/20 0.32
▸ C3AR1 Q16581 1/20 0.32
▸ NPY2R P49146 3/20 0.32
▸ NPY5R Q15761 3/20 0.32
▸ ITGB3 P05106 1/20 0.31
▸ ITGA2B P08514 1/20 0.31
▸ FOLH1 Q04609 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL14848974 0.90 C3AR1 (0.34) NPY4RNPY1RC3AR1ITGB3ITGA2B
SCHEMBL14848982 0.82 C3AR1 (0.39) NPY4RNPY1RC3AR1ITGB3ITGA2B
SCHEMBL18806927 0.82 C3AR1 (0.36) NPY4RNPY1RC3AR1ITGB3ITGA2B
SCHEMBL14228397 0.80 NPY4R (0.35) NPY4RNPY1RC3AR1NPY2RNPY5R
SCHEMBL19090970 0.80 NPY4R (0.35) NPY4RNPY1RC3AR1NPY2RNPY5R
SCHEMBL9298017 0.79 NPY4R (0.36) NPY4RNPY1RC3AR1NPY2RNPY5R
SCHEMBL14199839 0.79 NPY4R (0.36) NPY4RNPY1RC3AR1NPY2RNPY5R
SCHEMBL4572695 0.77 FOLH1 (0.36) NPY4RNPY1RC3AR1NPY2RNPY5R
SCHEMBL30493180 0.77 FOLH1 (0.36) NPY4RNPY1RC3AR1NPY2RNPY5R
SCHEMBL4782556 0.77 NPY4R (0.38) NPY4RNPY1RC3AR1NPY2RNPY5R

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
US-9932540-B2 Method for refining lipid phases, and use DREI LILIEN PVG GMBH & CO. KG (DE) 2018-04-03 — — US disclosed
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