SCHEMBL8487590

SCHEMBL8487590

CCOP(=O)(CCCCCCc1cc[c]cc1)OCC

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.38
ENPP2 Q13822 1/20 0.37
S1PR2 O95136 2/20 0.35
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
S1PR4 O95977 1/20 0.35

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
SCHEMBL8483893 1.00 PPARD (0.38) PPARDENPP2S1PR2S1PR1S1PR3
SCHEMBL8486626 0.98 PPARD (0.39) PPARDENPP2
SCHEMBL6898444 0.87 PPARD (0.42) PPARD
SCHEMBL14890455 0.84 CETP (0.50)
SCHEMBL7331812 0.82 CETP (0.47)
SCHEMBL8483551 0.80 PSEN1 (0.40) PPARDS1PR2S1PR1S1PR3
SCHEMBL8487838 0.80 PSEN1 (0.40) PPARDS1PR2S1PR1S1PR3
SCHEMBL11301094 0.79 KCNH2 (0.42)
SCHEMBL8486224 0.78 PSEN1 (0.38) PPARD
SCHEMBL8658558 0.77 CETP (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1090621-C Process for preparing quinazolin-4-one derivatives OTSUKA PHARMA CO LTD (JP) 2002-09-11 CN disclosed
US-5922866-A REACTING A TRIALKYLSILYL HALIDE WITH A 1,2-AMIDE SUBSTITUTED BENZENE DERIVATIVE IN THE PRESENCE OF A BASE; USE AS PHARMACEUTICALS OR INTERMEDIATES FOR SYNTHESIS THEREOF, SUCH AS ANTIDIABETIC DRUGS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1999-07-13 US disclosed
CN-1193967-A Process for producing quinazoline-4-one derivatives OTSUKA PHARMA CO LTD (US) 1998-09-23 CN disclosed