SCHEMBL4589435

SCHEMBL4589435

NCC(=O)NC(Cc1c[nH]cn1)C(=O)NC(Cc1ccccc1)C(=O)O.[Mn]

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.45
ITGB3 P05106 2/20 0.45
ITGA2B P08514 2/20 0.45
SLC15A2 Q16348 1/20 0.43
GNPAT O15228 1/20 0.43
MMP2 P08253 1/20 0.43
MMP7 P09237 1/20 0.43
MMP9 P14780 1/20 0.43
MMP12 P39900 1/20 0.43
MMP13 P45452 1/20 0.43
ACE P12821 1/20 0.42
CPA1 P15085 1/20 0.42
ACE2 Q9BYF1 1/20 0.42

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
SCHEMBL5598794 0.99 MME (0.46) MMEITGB3ITGA2BSLC15A2GNPAT
SCHEMBL30692732 0.99 MME (0.46) MMEITGB3ITGA2BSLC15A2GNPAT
SCHEMBL5598789 0.99 MME (0.46) MMEITGB3ITGA2BSLC15A2GNPAT
SCHEMBL2244563 0.98 MME (0.45) MMEITGB3ITGA2BSLC15A2GNPAT
SCHEMBL7799086 0.91 SLC15A2 (0.54) ITGB3ITGA2BSLC15A2GNPAT
SCHEMBL7806530 0.91 SLC15A2 (0.54) ITGB3ITGA2BSLC15A2GNPAT
SCHEMBL8012953 0.91 SLC15A2 (0.54) ITGB3ITGA2BSLC15A2GNPAT
SCHEMBL9390320 0.91 SLC15A2 (0.54) ITGB3ITGA2BSLC15A2GNPAT
SCHEMBL29590566 0.91 SLC15A2 (0.49) MMEITGB3ITGA2BSLC15A2
SCHEMBL20783813 0.91 SLC15A2 (0.49) MMEITGB3ITGA2BSLC15A2

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 MME 456/4885ITGB3 2875/4885ITGA2B 2979/4885
US-20060018851-A1 Methods and compositions for preventing and treating hyperpigmentation of skin RBP1, RBP4, MC1R MME 840/4885ITGB3 3184/4885ITGA2B 3154/4885
US-20080255032-A1 METHODS AND COMPOSITIONS FOR PREVENTING AND TREATING AGING OR PHOTODAMAGED SKIN RBP1, RBP4, SOD1 MME 456/4885ITGB3 2875/4885ITGA2B 2979/4885

“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.