SCHEMBL7750601

SCHEMBL7750601

O=C(NCc1ccc(O)cc1)C(CCCNc1ncc[nH]1)NC(=O)C(c1ccccc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 19/20 0.58
NPFFR1 Q9GZQ6 2/20 0.58
NPFFR2 Q9Y5X5 2/20 0.58
NPY5R Q15761 2/20 0.58
NPY4R P50391 3/20 0.52

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
SCHEMBL8112599 0.94 NPY1R (0.51) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7751625 0.90 NPY1R (0.48) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7746038 0.89 NPY1R (0.46) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL8127520 0.86 NPY1R (0.45) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL4653094 0.85 NPY1R (0.47) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7801972 0.83 NPY1R (0.42) NPY1RNPFFR1NPFFR2NPY5R
SCHEMBL8119514 0.82 HDAC1 (0.56) NPY1RNPFFR1NPFFR2
SCHEMBL4650854 0.82 MCHR1 (0.50)
SCHEMBL7750631 0.81 NPY1R (0.58) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7793040 0.81 CHRM2 (0.40) NPY1RNPFFR1NPFFR2NPY5R

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-0680469-B1 AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME BOEHRINGER INGELHEIM PHARMA (DE) 2000-04-26 EP claimed
US-6313128-B1 CAN BE USED AS LYPOLYSIS/LYPOGENESIS REGULATORS IN THE SKIN WITHOUT, INTERFERRING WITH THE SKIN'S NATURAL FUNCTIONS; FOR THERAPY OF SABORRHEA AND ACNE SANOFI-SYNTHELABO (FR) 2001-11-06 US disclosed
EP-0680469-B1 AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME BOEHRINGER INGELHEIM PHARMA (DE) 2000-04-26 EP disclosed