SCHEMBL4587351

SCHEMBL4587351

CC(N)C(=O)NC(CCCNC(=N)N)C(=O)O.[Mn]

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 3/20 0.51
NPY4R P50391 14/20 0.43
NPY1R P25929 9/20 0.43
NPY5R Q15761 8/20 0.43
NPY2R P49146 5/20 0.43
FOLH1 Q04609 1/20 0.39
GNPAT O15228 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
SCHEMBL29787128 0.99 NOD1 (0.52) NOD1NPY4RNPY1RNPY5RNPY2R
SCHEMBL5598692 0.99 NOD1 (0.52) NOD1NPY4RNPY1RNPY5RNPY2R
SCHEMBL2490761 0.99 NOD1 (0.52) NOD1NPY4RNPY1RNPY5RNPY2R
SCHEMBL29697052 0.99 NOD1 (0.52) NOD1NPY4RNPY1RNPY5RNPY2R
SCHEMBL31454130 0.99 NOD1 (0.52) NOD1NPY4RNPY1RNPY5RNPY2R
SCHEMBL2811179 0.97 NOD1 (0.51) NOD1NPY4RNPY1RNPY5RNPY2R
Hydrochloric Acid SCHEMBL9186802 0.97 NOD1 (0.51) NOD1NPY4RNPY1RNPY5RNPY2R
SCHEMBL23286096 0.96 NOD1 (0.50) NOD1NPY4RNPY1RNPY5RNPY2R
SCHEMBL1711604 0.96 NOD1 (0.50) NOD1NPY4RNPY1RNPY5RNPY2R
SCHEMBL1711608 0.96 NOD1 (0.50) NOD1NPY4RNPY1RNPY5RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255032-A1 METHODS AND COMPOSITIONS FOR PREVENTING AND TREATING AGING OR PHOTODAMAGED SKIN PROCYTE CORPORATION (US) 2008-10-16 US disclosed
US-7384916-B2 Methods and compositions for preventing and treating aging or photodamaged skin PROCYTE CORPORATION (US) 2008-06-10 US disclosed
US-20060246029-A1 Methods and compositions for preventing and treating aging or photodamaged skin PROCYTE CORPORATION (US) 2006-11-02 US disclosed
US-20060018851-A1 Methods and compositions for preventing and treating hyperpigmentation of skin PROCYTE CORPORATION (US) 2006-01-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060246029-A1 Methods and compositions for preventing and treating aging or photodamaged skin RBP1, RBP4, SOD1 NOD1 3887/4885NPY4R 3564/4885NPY1R 2475/4885
US-20060018851-A1 Methods and compositions for preventing and treating hyperpigmentation of skin RBP1, RBP4, MC1R NOD1 3746/4885NPY4R 3166/4885NPY1R 1480/4885
US-20080255032-A1 METHODS AND COMPOSITIONS FOR PREVENTING AND TREATING AGING OR PHOTODAMAGED SKIN RBP1, RBP4, SOD1 NOD1 3887/4885NPY4R 3564/4885NPY1R 2475/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.