SCHEMBL20072813

SCHEMBL20072813

CCCCC(C)C(=O)NC(CCCNC(=N)N)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 9/20 0.46
▸ NPY1R P25929 6/20 0.46
▸ PDF Q9HBH1 1/20 0.41
▸ BIRC2 Q13490 2/20 0.38
▸ NPY2R P49146 5/20 0.38
▸ NPY5R Q15761 5/20 0.38
▸ DPP7 Q9UHL4 1/20 0.38
▸ TAS1R3 Q7RTX0 2/20 0.37
▸ TAS1R1 Q7RTX1 2/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ SIRT6 Q8N6T7 1/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36

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
SCHEMBL21782578 0.95 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RHSD17B10
SCHEMBL17015152 0.85 NPY4R (0.50) NPY4RNPY1RPDFNPY2RNPY5R
SCHEMBL19299731 0.85 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL27431216 0.84 NPY4R (0.52) NPY4RNPY1RNPY2RNPY5R
SCHEMBL27431217 0.84 NPY4R (0.52) NPY4RNPY1RNPY2RNPY5R
SCHEMBL27404766 0.84 SIRT6 (0.45) NPY4RNPY1RNPY2RNPY5RSIRT6
SCHEMBL30434218 0.82 NPY4R (0.59) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL16263594 0.82 NPY4R (0.49) NPY4RNPY1RPDFNPY2RNPY5R
SCHEMBL27335222 0.81 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5R
SCHEMBL27335224 0.81 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5R

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-2018071033-A1 COACERVATE HYALURONAN HYDROGELS FOR DERMAL FILLER APPLICATIONS ALLERGAN, INC. (US) 2018-04-19 — — WO disclosed
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