SCHEMBL7521014

SCHEMBL7521014

C=CC(=O)OOC(CO)COC(=O)C(=C)C

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.46
PRKCA P17252 3/20 0.33
THRB P10828 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL282920 0.84 TSHR (0.49) TSHRPRKCA
SCHEMBL21976107 0.81 TSHR (0.52) TSHRTHRBALDH1A1
SCHEMBL4464394 0.79 TSHR (0.53) TSHRPRKCATHRBALDH1A1
SCHEMBL336611 0.78 TSHR (0.49) TSHRPRKCA
SCHEMBL27551476 0.78 TSHR (0.41) TSHRALDH1A1
SCHEMBL10798610 0.77 TSHR (0.47) TSHRPRKCATHRBALDH1A1
SCHEMBL18080879 0.76 TSHR (0.50) TSHRTHRBALDH1A1
SCHEMBL176350 0.76 TSHR (0.50) TSHRTHRBALDH1A1
SCHEMBL700973 0.76 TSHR (0.50) TSHRTHRBALDH1A1
SCHEMBL14944 0.75 TSHR (0.57) TSHRPRKCATHRB

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
US-20020028287-A1 Manufacture of optical fiber and optical fiber tape SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-03-07 US disclosed
EP-1182178-A1 Manufacture of optical fiber and optical fiber tape SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-02-27 EP disclosed