SCHEMBL7645703

SCHEMBL7645703

CCCCC(CCCC)OC(=O)OC(CCCC)CCCC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.46
CA2 P00918 6/20 0.43
CA1 P00915 3/20 0.43
MAPK1 P28482 2/20 0.43
PRKCA P17252 1/20 0.42
PRKCD Q05655 1/20 0.42
MAPT P10636 1/20 0.41
FDPS P14324 1/20 0.39
LMNA P02545 3/20 0.39
ACHE P22303 1/20 0.38
BACE1 P56817 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PLA2G2C Q5R387 1/20 0.38

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
SCHEMBL2339946 0.95 CTSK (0.51) CTSKCA2CA1MAPK1PRKCA
SCHEMBL6278113 0.95 CA2 (0.45) CTSKCA2CA1MAPK1MAPT
SCHEMBL7648142 0.93 CA2 (0.48) CA2MAPK1MAPTLMNAALDH1A1
SCHEMBL7645781 0.93 CA2 (0.48) CA2MAPK1MAPTLMNAALDH1A1
SCHEMBL7645775 0.93 GPR84 (0.45) CA2CA1MAPK1MAPTFDPS
SCHEMBL8518835 0.91 GPR84 (0.48) CA2MAPK1MAPTLMNAALDH1A1
SCHEMBL7645314 0.91 GPR84 (0.48) CA2MAPK1MAPTLMNAALDH1A1
SCHEMBL7645699 0.91 GPR84 (0.48) CA2MAPK1MAPTLMNAALDH1A1
SCHEMBL608474 0.91 PRKCA (0.51) CTSKCA2CA1MAPK1PRKCA
SCHEMBL7940292 0.91 GPR84 (0.48) CA2MAPK1MAPTLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0905217-A1 Unleaded gasoline for direct injection gasoline engine NIPPON OIL CO. LTD. (JP) 1999-03-31 EP claimed
CN-118382612-A Method for producing blocked isocyanate compound and method for producing isocyanate compound 旭化成株式会社 2024-07-23 CN disclosed
US-10563038-B2 Polycarbonate resin composition and molded article produced therefrom LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2020-02-18 US disclosed
US-20160311999-A1 Polycarbonate Resin Composition and Molded Article Produced Therefrom LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2016-10-27 US disclosed
US-6475680-B1 Lithium secondary battery, its electrolyte, and electric apparatus using the same HITACHI, LTD. (JP) 2002-11-05 US disclosed
EP-0944126-A1 Lithium secondary battery, its electrolyte, and electric apparatus using the same Hitachi, Ltd. (JP) 1999-09-22 EP disclosed
EP-0905217-A1 Unleaded gasoline for direct injection gasoline engine NIPPON OIL CO. LTD. (JP) 1999-03-31 EP disclosed