SCHEMBL7061450

SCHEMBL7061450

CS(=O)(=O)c1cc(C(=O)N=C(N)NCS(=O)(=O)O)ccc1N1CCCCC1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 5/20 0.71
SLC9A2 Q9UBY0 1/20 0.40

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
Sulfuric Acid SCHEMBL8816679 0.84 SLC9A1 (0.95) SLC9A1SLC9A2
SCHEMBL8816063 0.84 SLC9A1 (0.71) SLC9A1
SCHEMBL3906519 0.84 SLC9A1 (1.00) SLC9A1SLC9A2
SCHEMBL29357040 0.84 SLC9A1 (1.00) SLC9A1SLC9A2
SCHEMBL611261 0.83 SLC9A1 (0.74) SLC9A1
SCHEMBL8813228 0.83 SLC9A1 (0.70) SLC9A1
Hydrochloric Acid SCHEMBL9436783 0.82 SLC9A1 (0.98) SLC9A1SLC9A2
Hydrochloric Acid SCHEMBL9436769 0.82 SLC9A1 (0.98) SLC9A1SLC9A2
SCHEMBL8813805 0.81 SLC9A1 (0.70) SLC9A1
SCHEMBL8814641 0.80 SLC9A1 (0.69) SLC9A1SLC9A2

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
WO-2003051296-A2 IMPROVED SKIN BARRIER FUNCTION AND COHESION THROUGH ENHANCED STRATUM CORNEUM ACIDIFICATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-06-26 WO disclosed
WO-2003051295-A2 NEUTRALIZATION OF STRATUM CORNEUM TO TREAT HYPERKERATOTIC SKIN LESIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-06-26 WO disclosed
US-20030113352-A1 Neutralization of stratum corneum to treat hyperkeratotic skin lesions THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-06-19 US disclosed
US-20030113312-A1 Skin barrier function and cohesion through enhanced stratum corneum acidification THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-06-19 US disclosed