SCHEMBL9709244

SCHEMBL9709244

CC[Si](C)(C)OC(=O)C(C)=CC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.33
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 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
SCHEMBL5164501 0.79 HTT (0.33) HTTALDH1A1KDM4E
SCHEMBL5167754 0.79 HTT (0.33) HTTALDH1A1KDM4E
SCHEMBL28605109 0.75 HTT (0.33) HTTALDH1A1
SCHEMBL8665771 0.73 HCAR2 (0.33) ALDH1A1
SCHEMBL8667060 0.73 HCAR2 (0.33) ALDH1A1
SCHEMBL8665775 0.73 HCAR2 (0.33) ALDH1A1
SCHEMBL5839559 0.73 ALDH1A1 (0.44) ALDH1A1
SCHEMBL554289 0.71 NPSR1 (0.48) ALDH1A1KDM4ECYP1A2CYP2C19
SCHEMBL598483 0.71 NPSR1 (0.48) ALDH1A1KDM4ECYP1A2CYP2C19
SCHEMBL7772643 0.71 NPSR1 (0.48) ALDH1A1KDM4ECYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0244835-B1 LANGMUIR-BLODGETT ULTRATHIN MEMBRANE OF POLYFUMURATE NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1992-08-26 EP claimed
US-4907038-A Langmuir Blodgett ultrathin membrane of polyfumarate NIPPON OIL AND FATS CO., LTD. (JP) 1990-03-06 US claimed
EP-0244835-A2 Langmuir-Blodgett ultrathin membrane of polyfumurate NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1987-11-11 EP claimed
EP-0244835-B1 LANGMUIR-BLODGETT ULTRATHIN MEMBRANE OF POLYFUMURATE NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1992-08-26 EP disclosed
US-4907038-A Langmuir Blodgett ultrathin membrane of polyfumarate NIPPON OIL AND FATS CO., LTD. (JP) 1990-03-06 US disclosed
EP-0244835-A2 Langmuir-Blodgett ultrathin membrane of polyfumurate NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1987-11-11 EP disclosed