SCHEMBL4428080

SCHEMBL4428080

CC(C)(O)C(=O)c1ccc(C(OCC(CO)(CO)COC(c2ccc(C(=O)C(C)(C)O)cc2)c2ccc(C(=O)C(C)(C)O)cc2)c2ccc(C(=O)C(C)(C)O)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 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
SCHEMBL4421937 0.97 ELANE (0.31) ELANE
SCHEMBL4418529 0.97 ELANE (0.31) ELANE
SCHEMBL4420903 0.93 CTNNB1 (0.30)
SCHEMBL4427204 0.93 CTNNB1 (0.30)
SCHEMBL4418953 0.88 ELANE (0.31) ELANE
SCHEMBL4422392 0.86 ELANE (0.33) ELANE
SCHEMBL4418465 0.84 MLYCD (0.36) ELANE
SCHEMBL4421789 0.83 SLC6A4 (0.37)
SCHEMBL4422002 0.82 SLC6A4 (0.35)
SCHEMBL4414842 0.81 BCHE (0.36) ELANE

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-1620475-B1 NOVEL TRIFUNCTIONAL PHOTOINITIATORS BASF SE (DE) 2009-11-11 EP disclosed
US-7462650-B2 Trifunctional photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-12-09 US disclosed
US-20060270748-A1 Novel trifunctional photoinitiators IGM GROUP B.V. (NL) 2006-11-30 US disclosed