SCHEMBL3847233

SCHEMBL3847233

[CH2]C(C)(C)COC(=O)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.41
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ELANE P08246 3/20 0.32
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
BTN3A1 O00481 2/20 0.31
ENO1 P06733 1/20 0.30
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL733594 0.79 PRKCA (0.43) PRKCAPOLBGAANPSR1ELANE
SCHEMBL12561094 0.79 PRKCA (0.43) PRKCAPOLBGAANPSR1ELANE
SCHEMBL15891838 0.79 PRKCA (0.43) PRKCAPOLBGAANPSR1ELANE
SCHEMBL5445288 0.79 PRKCA (0.43) PRKCAPOLBGAANPSR1ELANE
SCHEMBL4115382 0.77
SCHEMBL9293781 0.77 PRKCA (0.42) PRKCAPOLBGAANPSR1ELANE
SCHEMBL9293784 0.77 PRKCA (0.42) PRKCAPOLBGAANPSR1ELANE
Hydrogen Peroxide SCHEMBL28451976 0.77 PRKCA (0.42) PRKCAPOLBGAANPSR1ELANE
SCHEMBL12135291 0.76 PRKCA (0.38) PRKCAPOLBGAANPSR1ELANE
SCHEMBL2692345 0.75 HTT (0.50) PRKCAPOLBGAANPSR1ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1734095-B1 MOISTURE-CURABLE POLYURETHANE HOT MELT ADHESIVE DAINIPPON INK & CHEMICALS (JP) 2014-10-08 EP disclosed
US-20140141161-A1 SPRAYABLE FLAME RESISTANT POLYURETHANE COATING COMPOSITION DOW GLOBAL TECHNOLOGIES LLC (US) 2014-05-22 US disclosed
WO-2013003261-A2 SPRAYABLE FLAME RESISTANT POLYURETHANE COATING COMPOSITION DOW GLOBAL TECHNOLOGIES LLC (US) 2013-01-03 WO disclosed
US-7612151-B2 Moisture-curable polyurethane hot-melt adhesive DAINIPPON INK AND CHEMICALS, INC. (JP) 2009-11-03 US disclosed
US-20070232764-A1 Moisture-Curable Polyurethane Hot-Melt Adhesive DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-10-04 US disclosed
EP-1734095-A1 MOISTURE-CURABLE POLYURETHANE HOT MELT ADHESIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-12-20 EP disclosed