SCHEMBL7419957

SCHEMBL7419957

N=C(N)NCCCC(N)C(=O)NC([C]=O)CS

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 11/20 0.39
NPY1R P25929 6/20 0.39
NPY2R P49146 4/20 0.39
NPY5R Q15761 4/20 0.39
DPP7 Q9UHL4 3/20 0.37
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
RRM1 P23921 1/20 0.32
DPP4 P27487 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
OTC P00480 1/20 0.31
FNTA P49354 2/20 0.31
FNTB P49356 2/20 0.31
PGGT1B P53609 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL7419967 1.00 NPY4R (0.39) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL2183420 0.90 NPY4R (0.41) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL1521188 0.90 NPY4R (0.41) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL1521191 0.90 NPY4R (0.41) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL11597903 0.89 FNTA (0.36) NPY4RNPY1RNPY2RNPY5RFNTA
SCHEMBL2183995 0.89 NPY4R (0.46) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL9225106 0.88 NPY4R (0.40) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL9225097 0.88 NPY4R (0.40) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL8697740 0.84 GNAI3 (0.46) NPY4RNPY1RNPY2RNPY5RDPP7
SCHEMBL2182733 0.84 DPP7 (0.51) NPY4RNPY1RNPY2RNPY5RDPP7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0431113-A4 ATRIAL PEPTIDE DERIVATIVES 1992-01-22 EP disclosed
EP-0431113-A1 ATRIAL PEPTIDE DERIVATIVES ABBOTT LABORATORIES (US) 1991-06-12 EP disclosed
WO-1990014362-A1 ATRIAL PEPTIDE DERIVATIVES ABBOTT LABORATORIES (US) 1990-11-29 WO disclosed