SCHEMBL8417829

SCHEMBL8417829

CC(C)(O)C(CO)C(C)(C)O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PRKCA P17252 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
SCHEMBL5605951 0.82 THRB (0.33)
SCHEMBL14667651 0.74 ALDH1A1 (0.35) ALDH1A1
SCHEMBL1980637 0.74 TSHR (0.38) TSHRTDP1
SCHEMBL716466 0.71 TSHR (0.40) TSHRALDH1A1
SCHEMBL8417613 0.71
SCHEMBL18933045 0.69 DPP4 (0.32)
SCHEMBL9177786 0.69
SCHEMBL283398 0.69
SCHEMBL4310439 0.69
SCHEMBL14667648 0.69 ALDH1A1 (0.32) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5883209-A PROCESS FOR PRODUCING A VINYL CHLORIDE POLYMER HAVING A LARGE BULK SPECIFIC GRAVITY SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-03-16 US claimed
US-5883209-A PROCESS FOR PRODUCING A VINYL CHLORIDE POLYMER HAVING A LARGE BULK SPECIFIC GRAVITY SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-03-16 US disclosed
EP-0035268-B1 CHLORINATED ORGANIC COMPOUNDS HAVING THEIR RESISTANCE TO DETERIORATION ENHANCED BY 1,3-DICARBONYL COMPOUNDS ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1984-09-19 EP disclosed
US-4416797-A Chlorinated organic compounds having their resistance to deterioration enhanced by 1,3-dicarbonyl compounds ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1983-11-22 US disclosed
EP-0035268-A1 Chlorinated organic compounds having their resistance to deterioration enhanced by 1,3-dicarbonyl compounds ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1981-09-09 EP disclosed