SCHEMBL21111020

SCHEMBL21111020

C=C(C)C(=O)OC(C)OC(=O)C(C)Cl

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
ALDH1A1 P00352 2/20 0.38
THRB P10828 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
SCHEMBL7718280 0.88 TSHR (0.44) TSHRALDH1A1THRB
SCHEMBL538063 0.85 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL6904341 0.83 TSHR (0.48) TSHRALDH1A1THRB
SCHEMBL9733375 0.82 TSHR (0.45) TSHRALDH1A1THRB
SCHEMBL8574824 0.79 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL8598159 0.79 TSHR (0.45) TSHRALDH1A1THRB
SCHEMBL1419983 0.79 TSHR (0.46) TSHRALDH1A1THRB
Methacrylic Acid SCHEMBL7644148 0.79 TSHR (0.45) TSHRALDH1A1THRB
SCHEMBL15064605 0.77 TSHR (0.46) TSHRALDH1A1THRB
SCHEMBL9249841 0.77 TSHR (0.44) TSHRALDH1A1THRB

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
WO-2020196695-A1 SHRINKING FLUORESCENT GEL, ANALYTE CONCENTRATION MEASUREMENT METHOD, TESTING KIT, AND TESTING DEVICE 積水化学工業株式会社 2020-10-01 WO disclosed
US-20190226988-A1 ANALYTE CONCENTRATION MEASURING METHOD, PARTICLE CONTAINING AGGLUTINATED FLUORESCENT MATERIAL, AND INSPECTION DEVICE SEKISUI CHEMICAL CO., LTD. (JP) 2019-07-25 US disclosed
EP-3508852-A1 ANALYTE CONCENTRATION MEASURING METHOD, PARTICLE CONTAINING AGGLUTINATED FLUORESCENT MATERIAL, AND INSPECTION DEVICE Sekisui Chemical Co., Ltd. (JP) 2019-07-10 EP disclosed