SCHEMBL4622979

SCHEMBL4622979

CCCOCC(=O)C(OCCC)(OCCC)C(=O)[O-].CCCOCC(=O)C(OCCC)(OCCC)C(=O)[O-].CCCOCC(=O)C(OCCC)(OCCC)C(=O)[O-].CCCOCC(=O)C(OCCC)(OCCC)C(=O)[O-].[Ti+4]

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.40

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
SCHEMBL7642803 0.86 CES2 (0.49) CES2
SCHEMBL2384263 0.81 FFAR3 (0.38) CES2
SCHEMBL28344100 0.81 CES2 (0.42) CES2
SCHEMBL105851 0.78 FFAR3 (0.38) CES2
SCHEMBL104420 0.78 FFAR3 (0.38) CES2
SCHEMBL104903 0.78 FFAR3 (0.38) CES2
SCHEMBL6138567 0.76 CES2 (0.38) CES2
SCHEMBL16320556 0.76 CES2 (0.38) CES2
SCHEMBL107315 0.73 CES2 (0.41) CES2
SCHEMBL108937 0.73 CES2 (0.41) CES2

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
EP-0931820-B1 Coating composition and its cured product JSR CORP (JP) 2008-03-19 EP disclosed
US-6214416-B1 STORAGE STABILITY; PRODUCES COATING FILMS WITH GOOD APPEARANCE, ADHESION, WEATHER RESISTANCE, HARDNESS JSR CORPORATION (JP) 2001-04-10 US disclosed
EP-0931820-A1 Coating composition and its cured product JSR Corporation (JP) 1999-07-28 EP disclosed