SCHEMBL27347692

SCHEMBL27347692

COC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(C)C

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.61
▸ NPY1R P25929 9/20 0.61
▸ NPY5R Q15761 8/20 0.51
▸ NPY2R P49146 5/20 0.51
▸ FOLH1 Q04609 1/20 0.43
▸ ERAP2 Q6P179 1/20 0.43
▸ MME P08473 1/20 0.39
▸ BIRC2 Q13490 1/20 0.38

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
SCHEMBL27347693 1.00 NPY4R (0.61) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL30434218 0.90 NPY4R (0.59) NPY4RNPY1RNPY5RNPY2RERAP2
Hydrochloric Acid SCHEMBL29508688 0.88 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RERAP2
SCHEMBL29947050 0.88 NPY4R (0.59) NPY4RNPY1RNPY5RNPY2R
Hydrochloric Acid SCHEMBL30380134 0.88 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RERAP2
Hydrochloric Acid SCHEMBL29726986 0.88 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RERAP2
SCHEMBL29492562 0.87 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL30379845 0.87 NPY4R (0.63) NPY4RNPY1RNPY5RNPY2RERAP2
SCHEMBL18671821 0.87 NPY4R (0.52) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL29492567 0.87 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RFOLH1

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
CN-1062536-A Retroviral protease inhibitors from 3-chloro-2-chloromethyl-1-propylene derived AMERICAN CYANAMID CO (US) 1992-07-08 — — CN disclosed
Send feedback