SCHEMBL7054539

SCHEMBL7054539

CCCCCCCC(=O)OCCC(O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.71
MAPT P10636 1/20 0.61
DNM1 Q05193 1/20 0.59
LMNA P02545 4/20 0.57
KDM4E B2RXH2 1/20 0.57
DUSP3 P51452 1/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
PAM P19021 2/20 0.55
ALDH1A1 P00352 1/20 0.54
TSHR P16473 1/20 0.51
PRSS1 P07477 1/20 0.51
PRSS2 P07478 1/20 0.51
PRSS3 P35030 1/20 0.51
LPAR6 P43657 1/20 0.50
LPAR1 Q92633 1/20 0.50
LPAR4 Q99677 1/20 0.50
LPAR5 Q9H1C0 1/20 0.50
LPAR2 Q9HBW0 1/20 0.50
LPAR3 Q9UBY5 1/20 0.50

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
SCHEMBL2014242 1.00 DGKA (0.71) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL7549031 1.00 DGKA (0.71) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL7048642 1.00 DGKA (0.71) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL7052207 0.98 DGKA (0.68) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL35584 0.87 DGKA (0.69) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL2864987 0.87 DGKA (0.69) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL8730928 0.87 DGKA (0.69) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL19409845 0.85 DGKA (0.71) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL2397395 0.85 DGKA (0.71) DGKAMAPTDNM1LMNAKDM4E
SCHEMBL120186 0.85 DGKA (0.71) DGKAMAPTDNM1LMNAKDM4E

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
EP-3204038-A1 COMPOSITIONS AND KITS FOR TREATING PRURITUS AND METHODS OF USING THE SAME Rochal Industries, LLC (US) 2017-08-16 EP disclosed
WO-2016057789-A1 COMPOSITIONS AND KITS FOR TREATING PRURITUS AND METHODS OF USING THE SAME ROCHAL INDUSTRIES, LLC (US) 2016-04-14 WO disclosed
EP-0797443-B1 A PHARMACEUTICAL COMPOSITION WITH IMPROVED BIO-AVAILABILITY OF INOSITOL PHOSPHATE BIONERIS AB (SE) 2003-04-23 EP disclosed
US-5760022-A ESTER, ETHER PERSTORP AB (SE) 1998-06-02 US disclosed
EP-0797443-A1 A PHARMACEUTICAL COMPOSITION WITH IMPROVED BIO-AVAILABILITY OF INOSITOL PHOSPHATE PERSTORP AB (SE) 1997-10-01 EP disclosed
WO-1995019775-A1 A PHARMACEUTICAL COMPOSITION WITH IMPROVED BIO-AVAILABILITY OF INOSITOL PHOSPHATE PERSTORP AB (SE) 1995-07-27 WO disclosed