SCHEMBL2502768

SCHEMBL2502768

CCCCCCCCCCCCCCCCC(O)CN(CCP(=O)(O)O)C(=O)CCC

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 6/20 0.44
S1PR1 P21453 6/20 0.44
S1PR3 Q99500 6/20 0.44
S1PR4 O95977 4/20 0.44
FFAR4 Q5NUL3 1/20 0.43
FFAR1 O14842 1/20 0.43
FDPS P14324 3/20 0.42
LPAR3 Q9UBY5 3/20 0.42
LPAR2 Q9HBW0 1/20 0.42
S1PR5 Q9H228 1/20 0.42
NFKB1 P19838 1/20 0.42
GPR84 Q9NQS5 3/20 0.41
LAP3 P28838 1/20 0.41

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
SCHEMBL7787361 0.86 S1PR2 (0.44) S1PR2S1PR1S1PR3S1PR4FFAR1
SCHEMBL9668817 0.85 S1PR2 (0.44) S1PR2S1PR1S1PR3S1PR4FFAR4
SCHEMBL2639555 0.84 FFAR1 (0.46) FFAR4FFAR1NFKB1GPR84
SCHEMBL7584644 0.84 FFAR1 (0.46) FFAR4FFAR1NFKB1GPR84
SCHEMBL7584671 0.83 FFAR1 (0.45) FFAR4FFAR1NFKB1GPR84
SCHEMBL2639401 0.82 LPAR5 (0.52) S1PR2S1PR1S1PR3LPAR3LPAR2
SCHEMBL9506889 0.82 LPAR5 (0.52) S1PR2S1PR1S1PR3LPAR3LPAR2
SCHEMBL7584666 0.81 FFAR1 (0.49) FFAR4FFAR1NFKB1GPR84
SCHEMBL2502773 0.81 FFAR1 (0.43) FFAR4FFAR1NFKB1GPR84
SCHEMBL25139921 0.80 FFAR4 (0.51) FFAR4FFAR1NFKB1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1534213-B1 WATER-BASED DELIVERY SYSTEMS SKOELD THOMAS (SE) 2013-04-24 EP claimed
JP-4806519-B2 2011-11-02 JP claimed
US-20090226491-A1 Water-based delivery systems SKOLD, THOMAS (SE) 2009-09-10 US claimed
US-20090081139-A1 Water-based delivery systems GALDERMA LABORATORIES, INC. 2009-03-26 US claimed
WO-2006039667-A2 WATER-BASED DELIVERY SYSTEMS COLLAGENEX PHARMACEUTICALS, INC. (US) 2006-04-13 WO claimed
EP-1534213-A4 WATER-BASED DELIVERY SYSTEMS COLLAGENEX PHARM INC (US) 2005-10-26 EP claimed
US-20050129722-A1 For an active substance, characterized by enhancing skin barrier restoration in the stratum corneum comprising a fatty acid, cholesterol, a ceramide and at least one skin lipid precursor; topical drug delivery COLLAGENEX PHARMACEUTICALS, INC. 2005-06-16 US claimed
EP-1534213-A2 WATER-BASED DELIVERY SYSTEMS Collagenex Pharmaceuticals, Inc. (US) 2005-06-01 EP claimed
US-20040009213-A1 Water-based delivery systems COLLAGENEX PHARMACEUTICALS, INC. 2004-01-15 US claimed
WO-2003077861-A2 WATER-BASED DELIVERY SYSTEMS COLLAGENEX PHARMACEUTICALS, INC. (US) 2003-09-25 WO claimed
EP-1534213-B1 WATER-BASED DELIVERY SYSTEMS SKOELD THOMAS (SE) 2013-04-24 EP disclosed
US-8029810-B2 Water-based delivery systems Skold, Thomas (SE) 2011-10-04 US disclosed
US-20090226491-A1 Water-based delivery systems SKOLD, THOMAS (SE) 2009-09-10 US disclosed
US-20090081139-A1 Water-based delivery systems GALDERMA LABORATORIES, INC. 2009-03-26 US disclosed
EP-1534213-A4 WATER-BASED DELIVERY SYSTEMS COLLAGENEX PHARM INC (US) 2005-10-26 EP disclosed
US-20050129722-A1 For an active substance, characterized by enhancing skin barrier restoration in the stratum corneum comprising a fatty acid, cholesterol, a ceramide and at least one skin lipid precursor; topical drug delivery COLLAGENEX PHARMACEUTICALS, INC. 2005-06-16 US disclosed
EP-1534213-A2 WATER-BASED DELIVERY SYSTEMS Collagenex Pharmaceuticals, Inc. (US) 2005-06-01 EP disclosed
US-20040009213-A1 Water-based delivery systems COLLAGENEX PHARMACEUTICALS, INC. 2004-01-15 US disclosed
WO-2003077861-A2 WATER-BASED DELIVERY SYSTEMS COLLAGENEX PHARMACEUTICALS, INC. (US) 2003-09-25 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 (2 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-20050129722-A1 For an active substance, characterized by enhancing skin barrier restoration in the stratum corneum comprising a fatty acid, cholesterol, a ceramide and at least one skin lipid precursor; topical drug delivery CERT1, CERS2, SGMS1 S1PR2 43/4885S1PR1 33/4885S1PR3 40/4885
US-20090226491-A1 Water-based delivery systems CERS2, SGMS2, SGMS1 S1PR2 55/4885S1PR1 48/4885S1PR3 49/4885

“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.