SCHEMBL29061966

SCHEMBL29061966

CCC(CO)(CO)CO.CCC(CO)(CO)CO.CCC(CO)(CO)CO.OCC(CO)(CO)CO

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL6397507 1.00 TSHR (0.39) TSHRALDH1A1TDP1
SCHEMBL1537444 1.00 TSHR (0.39) TSHRALDH1A1TDP1
SCHEMBL597158 1.00 TSHR (0.39) TSHRALDH1A1TDP1
SCHEMBL5907424 0.96 TSHR (0.41) TSHRALDH1A1TDP1
SCHEMBL175428 0.96 TSHR (0.41) TSHRALDH1A1TDP1
SCHEMBL15026 0.96
SCHEMBL4379385 0.96
Methyl Alcohol SCHEMBL9651704 0.92 TSHR (0.39) TSHRALDH1A1TDP1
SCHEMBL5161170 0.92 TSHR (0.39) TSHRALDH1A1TDP1
Water SCHEMBL1898758 0.92 TSHR (0.39) TSHRALDH1A1TDP1

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
CN-116731775-A Refrigerating cycle device, refrigerating machine oil, and refrigerant leakage preventing agent 大金工业株式会社 2023-09-12 CN disclosed
CN-114867828-B Refrigerating cycle device, refrigerating machine oil, and refrigerant leakage preventing agent 大金工业株式会社 2023-07-14 CN disclosed