SCHEMBL4588249

SCHEMBL4588249

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

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC15A2 Q16348 1/20 0.41
ITGB3 P05106 7/20 0.36
ITGA2B P08514 7/20 0.36
CPB2 Q96IY4 6/20 0.35
CPB1 P15086 1/20 0.35
CTSC P53634 2/20 0.33
PIN1 Q13526 1/20 0.33
P2RY14 Q15391 1/20 0.33
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL1666820 0.99 SLC15A2 (0.42) SLC15A2ITGB3ITGA2BCPB2CPB1
SCHEMBL483799 0.99 SLC15A2 (0.42) SLC15A2ITGB3ITGA2BCPB2CPB1
Hydrochloric Acid SCHEMBL2199717 0.97 SLC15A2 (0.41) SLC15A2ITGB3ITGA2BCPB2CPB1
SCHEMBL2811067 0.97 SLC15A2 (0.41) SLC15A2ITGB3ITGA2BCPB2CPB1
Hydrochloric Acid SCHEMBL1436163 0.97 SLC15A2 (0.41) SLC15A2ITGB3ITGA2BCPB2CPB1
SCHEMBL30954680 0.97 SLC15A2 (0.41) SLC15A2ITGB3ITGA2BCPB2CPB1
SCHEMBL29590566 0.93 SLC15A2 (0.49) SLC15A2ITGB3ITGA2BCPB2CPB1
SCHEMBL20783813 0.93 SLC15A2 (0.49) SLC15A2ITGB3ITGA2BCPB2CPB1
SCHEMBL31453803 0.93 SLC15A2 (0.49) SLC15A2ITGB3ITGA2BCPB2CPB1
SCHEMBL29888249 0.90 SLC15A2 (0.44) SLC15A2ITGB3ITGA2BCPB2CPB1

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 6 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
EP-1765280-A1 METHODS AND COMPOSITIONS FOR PREVENTING AND TREATING HYPERPIGMENTATION OF SKIN PROCYTE CORPORATION (US) 2007-03-28 EP 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
WO-2006004787-A1 METHODS AND COMPOSITIONS FOR PREVENTING AND TREATING HYPERPIGMENTATION OF SKIN PROCYTE CORPORATION (US) 2006-01-12 WO 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 SLC15A2 2656/4885ITGB3 2875/4885ITGA2B 2979/4885
US-20060018851-A1 Methods and compositions for preventing and treating hyperpigmentation of skin RBP1, RBP4, MC1R SLC15A2 1582/4885ITGB3 3184/4885ITGA2B 3154/4885
US-20080255032-A1 METHODS AND COMPOSITIONS FOR PREVENTING AND TREATING AGING OR PHOTODAMAGED SKIN RBP1, RBP4, SOD1 SLC15A2 2656/4885ITGB3 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.