SCHEMBL9709153

SCHEMBL9709153

CCOC(=O)/C=C/C(=O)O[Si](C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.59
ATM Q13315 1/20 0.48
MAPT P10636 5/20 0.44
NPSR1 Q6W5P4 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
LMNA P02545 3/20 0.41
HTT P42858 1/20 0.41
MDM2 Q00987 1/20 0.40
ALDH1A1 P00352 2/20 0.40
TTR P02766 1/20 0.39
DPP4 P27487 1/20 0.39

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
SCHEMBL6894763 1.00 HCAR2 (0.59) HCAR2ATMMAPTNPSR1CA12
Diethyl Maleate SCHEMBL27966383 0.83 HCAR2 (0.80) HCAR2ATMMAPTNPSR1CA12
SCHEMBL6049197 0.83 HCAR2 (0.45) HCAR2ATMALDH1A1
SCHEMBL9615496 0.83 HCAR2 (0.45) HCAR2ATMALDH1A1
Diethyl Maleate SCHEMBL43033 0.83 HCAR2 (0.80) HCAR2ATMMAPTNPSR1CA12
Diethyl Maleate SCHEMBL42602 0.83 HCAR2 (0.80) HCAR2ATMMAPTNPSR1CA12
Diethyl Maleate SCHEMBL2015896 0.83 HCAR2 (0.80) HCAR2ATMMAPTNPSR1CA12
Diethyl Maleate SCHEMBL60423 0.83 HCAR2 (0.80) HCAR2ATMMAPTNPSR1CA12
Diethyl Maleate SCHEMBL2015895 0.83 HCAR2 (0.80) HCAR2ATMMAPTNPSR1CA12
SCHEMBL16004844 0.83 HCAR2 (0.45) HCAR2ATMALDH1A1

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