SCHEMBL19682908

SCHEMBL19682908

C=C(C(=O)OCC)C(=O)OC(C)(C)CCOC(C)(C)C(=O)C(=C)C(=O)OCC

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.36
CYP4A11 Q02928 2/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.33

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
SCHEMBL19686005 0.85 ALDH1A1 (0.36) CYP4F2CYP4A11ALDH1A1MAPTTSHR
SCHEMBL19686153 0.79 ALDH1A1 (0.43) CYP4F2CYP4A11ALDH1A1MAPTTSHR
SCHEMBL21886158 0.77 CYP4F2 (0.42) CYP4F2CYP4A11ALDH1A1MAPTTSHR
SCHEMBL22758423 0.76 CYP4F2 (0.43) CYP4F2CYP4A11ALDH1A1MAPTTSHR
SCHEMBL12055952 0.75 THRB (0.33) ALDH1A1TSHR
SCHEMBL3864269 0.73 ALDH1A1 (0.44) ALDH1A1MAPTTSHR
SCHEMBL20953048 0.72 THRB (0.30)
SCHEMBL19686006 0.71 ALDH1A1 (0.33) ALDH1A1MAPTTSHR
SCHEMBL28293945 0.71 ALDH1A1 (0.56) ALDH1A1MAPTTSHR
SCHEMBL79588 0.71 ALDH1A1 (0.56) ALDH1A1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3464484-B1 WATER ABSORBING OR WATER SOLUBLE POLYMERS, INTERMEDIATE COMPOUNDS, AND METHODS THEREOF SIRRUS INC (US) 2020-07-29 EP disclosed
WO-2017210084-A1 WATER ABSORBING OR WATER SOLUBLE POLYMERS, INTERMEDIATE COMPOUNDS, AND METHODS THEREOF SIRRUS, INC. (US) 2017-12-07 WO disclosed