SCHEMBL8989558

SCHEMBL8989558

COC(CCCCC(=O)CP(=O)(O)O)CC(C)C

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 9/20 0.34
ANPEP P15144 3/20 0.33
LAP3 P28838 2/20 0.33
ERAP1 Q9NZ08 1/20 0.33
LPAR6 P43657 3/20 0.31
LPAR1 Q92633 3/20 0.31
LPAR4 Q99677 3/20 0.31
LPAR5 Q9H1C0 3/20 0.31
LPAR2 Q9HBW0 3/20 0.31
LPAR3 Q9UBY5 3/20 0.31

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
SCHEMBL2304432 0.80 KDM4C (0.39) LAP3
SCHEMBL11535258 0.79 SMPD1 (0.37) ENPP2LAP3
SCHEMBL2302042 0.79 KDM4C (0.41) LAP3
SCHEMBL7950976 0.79 KDM4C (0.41) LAP3
SCHEMBL7947910 0.79 KDM4C (0.41) LAP3
SCHEMBL7570633 0.79 KDM4C (0.41) LAP3
SCHEMBL4943737 0.75 CA1 (0.37) ANPEPLAP3ERAP1
SCHEMBL4054598 0.72 KDM1A (0.37)
SCHEMBL8989553 0.71 ENPP2 (0.35) ENPP2LPAR6LPAR1LPAR4LPAR5
SCHEMBL11516995 0.70 CA1 (0.44) ANPEPLAP3ERAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5534547-A Prostaglandins of the D series, and tranquilizers and soporifics containing the same KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1996-07-09 US disclosed
US-5137915-A PROSTAGLANDINS OF THE D SERIES, AND TRANQUILIZERS AND SOPORIFICS CONTAINING THE SAME K.K. UENO SEIYAKU OYO KENKYUJO (JP) 1992-08-11 US disclosed
EP-0281239-B1 PROSTAGLANDINS OF THE D SERIES, AND TRANQUILIZERS AND SOPORIFICS CONTAINING THE SAME Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1992-03-25 EP disclosed
US-5073569-A 13,14-dihydro-15-keto- K.K. UENO SEIYAKU OYO KENKYUJO (JP) 1991-12-17 US disclosed
EP-0281239-A2 Prostaglandins of the D series, and tranquilizers and soporifics containing the same Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1988-09-07 EP disclosed