SCHEMBL28882485

SCHEMBL28882485

CC(NC(=O)[C@@H](CCCN=C(N)N)NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 18/20 1.00
▸ NPY5R Q15761 5/20 1.00
▸ NPFFR1 Q9GZQ6 2/20 0.71
▸ NPFFR2 Q9Y5X5 2/20 0.71
▸ NPY4R P50391 2/20 0.61
▸ NPY2R P49146 1/20 0.61
▸ MCHR1 Q99705 1/20 0.56

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
SCHEMBL29416820 0.83 NPY1R (1.00) NPY1RNPY5RNPFFR1NPFFR2NPY4R
SCHEMBL28032820 0.82 NPY1R (0.70) NPY1RNPY5RNPFFR1NPFFR2NPY4R
SCHEMBL1593464 0.82 NPY1R (0.70) NPY1RNPY5RNPFFR1NPFFR2NPY4R
SCHEMBL29832882 0.81 NPY1R (0.76) NPY1RNPY5RNPFFR1NPFFR2NPY4R
Trifluoroacetic Acid SCHEMBL30887954 0.79 NPY1R (0.89) NPY1RNPY5RNPFFR1NPFFR2NPY4R
SCHEMBL29440093 0.76 NPY1R (1.00) NPY1RNPY5RNPFFR1NPFFR2NPY4R
SCHEMBL30555926 0.74 NPY1R (0.59) NPY1RNPY5RNPFFR1NPFFR2NPY4R
SCHEMBL29479269 0.74 NPY4R (0.68) NPY1RNPY5RNPFFR1NPFFR2NPY4R
SCHEMBL29936161 0.71 NPY4R (0.69) NPY1RNPY5RNPFFR1NPFFR2NPY4R
SCHEMBL22959426 0.70 CNR1 (0.56) NPY1RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108218849-B Novel inhibitors 维沃永治疗公众有限公司 2022-03-01 — — CN disclosed
CN-110719910-A Novel inhibitors 前体生物药物股份公司 2020-01-21 — — CN disclosed
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