SCHEMBL9305051

SCHEMBL9305051

C=C(C)C(=O)OCC(CO)OC(=O)C(=C)C.C=C(C)C(=O)OCCC(C)OC(=O)C(=C)C

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
THRB P10828 1/20 0.38
PRKCA P17252 5/20 0.37

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
SCHEMBL23573051 0.86 TSHR (0.59) TSHRTHRB
SCHEMBL24963 0.86 TSHR (0.52) TSHRTHRB
SCHEMBL14944 0.86 TSHR (0.57) TSHRTHRBPRKCA
SCHEMBL23882527 0.85 TSHR (0.49) TSHRTHRBPRKCA
SCHEMBL4593744 0.85 THRB (0.52) TSHRTHRB
Propane SCHEMBL8440363 0.83 THRB (0.50) TSHRTHRB
Ethylene Glycol SCHEMBL8134666 0.83 TSHR (0.53) TSHRTHRBPRKCA
SCHEMBL2587139 0.83 THRB (0.46) TSHRTHRBPRKCA
SCHEMBL15407 0.83 TSHR (0.53) TSHRTHRB
1,4-Butanediol SCHEMBL1225181 0.82 TSHR (0.45) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5330830-A Heat-resisting porous membrane, hydrophilized heat-resisting porous membrane and production processes thereof MITSUBISHI RAYON CO., LTD. (JP) 1994-07-19 US disclosed