SCHEMBL7903286

SCHEMBL7903286

NCCCCC(NC(=O)CN)C(=O)N1CCCC1(O)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 1/20 0.36
ITGB3 P05106 9/20 0.36
ITGA2B P08514 9/20 0.36
SLC15A2 Q16348 1/20 0.35
OPRK1 P41145 5/20 0.35
FOLH1 Q04609 1/20 0.34
SLC6A5 Q9Y345 1/20 0.33
F2 P00734 1/20 0.33

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
SCHEMBL468712 0.87 ITGB3 (0.43) CPB2ITGB3ITGA2BOPRK1SLC6A5
SCHEMBL3277465 0.80 DPP7 (0.45) ITGB3ITGA2B
SCHEMBL10870012 0.70 ITGB3 (0.34) CPB2ITGB3ITGA2BOPRK1FOLH1
SCHEMBL29363178 0.70 ACE (0.59)
SCHEMBL10391419 0.70 F2 (0.42) CPB2ITGB3ITGA2BOPRK1FOLH1
SCHEMBL1455499 0.70 FOLH1 (0.62) CPB2SLC15A2FOLH1SLC6A5
SCHEMBL1455498 0.70 FOLH1 (0.62) CPB2SLC15A2FOLH1SLC6A5
SCHEMBL3460653 0.70 FOLH1 (0.62) CPB2SLC15A2FOLH1SLC6A5
SCHEMBL8342623 0.68 DPP4 (0.32)
Ammonia Solution, Strong SCHEMBL4293156 0.68 FOLH1 (0.60) CPB2SLC15A2FOLH1SLC6A5

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
EP-1143925-A1 TOPICAL COMPOSITION COMPRISING N-ACETYLALDOSAMINES OR N-ACETYLAMINO ACIDS Yu, Ruey J., Dr. (US) 2001-10-17 EP disclosed
WO-2000040217-A1 TOPICAL COMPOSITION COMPRISING N-ACETYLALDOSAMINES OR N-ACETYLAMINO ACIDS YUGENIC LIMITED PARTNERSHIP (US) 2000-07-13 WO disclosed