SCHEMBL7206294

SCHEMBL7206294

C=C(C)COC(C)Oc1ccc(C(C)(C)c2ccc(OC(C)OCC(=C)C)c(OCC)c2OCC)c(OCC)c1OCC

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL11132360 0.85 KDM4E (0.31)
SCHEMBL2247894 0.83 ALDH1A1 (0.40)
SCHEMBL9486272 0.81 ALDH1A1 (0.39)
Methacrylic Acid SCHEMBL10842460 0.76 ALDH1A1 (0.38)
SCHEMBL5097398 0.76 ATM (0.33)
SCHEMBL9316178 0.75 ALDH1A1 (0.38)
SCHEMBL31195673 0.73 ALDH1A1 (0.39)
SCHEMBL3946616 0.72 KDM4E (0.39)
SCHEMBL29415623 0.72 CYP1A2 (0.35)
SCHEMBL64707 0.72 CYP1A2 (0.35)

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-6602333-B2 To provide image of high quality, and recorded matter of high image quality SEIKO EPSON CORPORATION (JP) 2003-08-05 US disclosed
US-20030029355-A1 Ink set for ink-jet recording, process for producing same, method of image recording, and print SEIKO EPSON CORPORATION (JP) 2003-02-13 US disclosed
EP-1153991-A1 INK SET FOR INK-JET RECORDING, PROCESS FOR PRODUCING THE SAME, METHOD OF IMAGE RECORDING, AND PRINT SEIKO EPSON CORPORATION (JP) 2001-11-14 EP disclosed
US-5380772-A Modelling liquid for dental porcelain G-C TOSHI KOGYO CORPORATION (JP) 1995-01-10 US disclosed
EP-0424168-A1 Polymer complexes of a sugar response type NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-04-24 EP disclosed