SCHEMBL19821799

SCHEMBL19821799

CCC(C)C(=O)OCCCC(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
LMNA P02545 3/20 0.38
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
DGKA P23743 1/20 0.37
MAPT P10636 2/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL11892835 0.89 TSHR (0.52) TSHRLMNAALDH1A1L3MBTL1DGKA
SCHEMBL12532804 0.89 TSHR (0.46) TSHRLMNAALDH1A1L3MBTL1MAPT
SCHEMBL12430271 0.85 TSHR (0.48) TSHRLMNAALDH1A1DGKAMAPT
SCHEMBL7924467 0.82 TSHR (0.56) TSHRLMNAALDH1A1L3MBTL1DGKA
Methyl 2-Methylbutanoate SCHEMBL3915351 0.81 TSHR (0.50) TSHRLMNAALDH1A1DGKAMAPT
SCHEMBL26363347 0.81 ALDH1A1 (0.34) ALDH1A1
SCHEMBL13645125 0.81 AKR1B1 (0.41) TSHRALDH1A1
SCHEMBL12796462 0.81 ALDH1A1 (0.34) ALDH1A1
SCHEMBL13137689 0.81 DGKA (0.34) TSHRLMNADGKAMAPTCA1
SCHEMBL3906915 0.80 DGKA (0.53) TSHRLMNAALDH1A1DGKAMAPT

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
US-20230143665-A1 FLUORINE-CONTAINING POLYMER, COMPOSITION, OPTICAL FILM, LIQUID CRYSTAL FILM, HARDCOAT FILM, AND POLARIZING PLATE FUJIFILM CORPORATION (JP) 2023-05-11 US disclosed
US-20230129965-A1 HYDROPHILIC AND OLEOPHOBIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed
US-20180030175-A1 POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 US disclosed