SCHEMBL7109933

SCHEMBL7109933

CC(C)O[Al+]OC(C)C.CCCCC(=O)CC(=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 1/20 0.43
CA1 P00915 4/20 0.42
CA2 P00918 4/20 0.39
CES1 P23141 2/20 0.38
CES2 O00748 1/20 0.38
LMNA P02545 2/20 0.36
NFKB1 P19838 1/20 0.34
FFAR3 O14843 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
PLA2G2A P14555 1/20 0.33
PLA2G5 P39877 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
MEN1 O00255 1/20 0.33
FAAH O00519 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL7112635 0.95 HAO1 (0.50) HAO1CA1CA2CES1CES2
SCHEMBL3707034 0.94 HAO1 (0.53) HAO1CES1CES2LMNAPLA2G2A
SCHEMBL17106144 0.94 HAO1 (0.53) HAO1CES1CES2LMNAPLA2G2A
SCHEMBL3702503 0.94 HAO1 (0.53) HAO1CES1CES2LMNAPLA2G2A
SCHEMBL237379 0.90 FFAR3 (0.40) HAO1CA1CA2CES1CES2
SCHEMBL29539255 0.88 FFAR3 (0.39) HAO1CA1CA2CES1CES2
SCHEMBL3699752 0.86 FABP3 (0.55) LMNAFAAH
SCHEMBL1078863 0.82 CA4 (0.33) CA1CA2
Hexanoate SCHEMBL1361560 0.81 CA1 (0.52) CA1CA2CES1CES2LMNA
SCHEMBL28470095 0.80 FFAR3 (0.38) CA1CA2CES1CES2FFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5800956-A Electrophotographic photoreceptor with specific interlayer KONICA CORPORATION (JP) 1998-09-01 US claimed
CN-113969119-A Sealing sheet and adhesive composition layer 味之素株式会社 2022-01-25 CN disclosed
US-10421865-B2 Rubber-metal adhesive NOK CORPORATION (JP) 2019-09-24 US disclosed
US-10421864-B2 Metal surface processing agent NOK CORPORATION (JP) 2019-09-24 US disclosed
US-20170037254-A1 RUBBER-METAL ADHESIVE NOK CORPORATION (JP) 2017-02-09 US disclosed
US-20150274989-A1 Metal Surface Processing Agent NOK CORPORATION (JP) 2015-10-01 US disclosed
EP-0763782-B1 Electrophotographic photoreceptor KONISHIROKU PHOTO IND (JP) 2003-03-26 EP disclosed
EP-0725316-B1 Electrophotographic photoreceptor KONISHIROKU PHOTO IND (JP) 1999-06-30 EP disclosed
US-5846679-A Electrophotographic photoreceptor KONICA CORPORATION (JP) 1998-12-08 US disclosed
US-5800956-A Electrophotographic photoreceptor with specific interlayer KONICA CORPORATION (JP) 1998-09-01 US disclosed
EP-0671663-B1 Electrophotographic photoreceptor KONISHIROKU PHOTO IND (JP) 1998-08-12 EP disclosed
EP-0763782-A1 Electrophotographic photoreceptor KONICA CORPORATION (JP) 1997-03-19 EP disclosed
EP-0725316-A1 Electrophotographic photoreceptor KONICA CORPORATION (JP) 1996-08-07 EP disclosed