SCHEMBL18917209

SCHEMBL18917209

C=CCC(=O)[O-].C=CCC(=O)[O-].[Fe+2]

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA4 P22748 2/20 0.37
BBOX1 O75936 2/20 0.35
CASP1 P29466 1/20 0.33
TSHR P16473 1/20 0.32
FFAR3 O14843 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL1919362 0.94 CA4 (0.37) CA4BBOX1CASP1TSHRFFAR3
SCHEMBL2542355 0.94
SCHEMBL2543416 0.94
Silver SCHEMBL4423921 0.94
Potassium Ion SCHEMBL1615163 0.94
SCHEMBL11779420 0.94 CA4 (0.37) CA4BBOX1CASP1TSHRFFAR3
SCHEMBL18886592 0.94 CA4 (0.37) CA4BBOX1CASP1TSHRFFAR3
SCHEMBL11668358 0.94 CA4 (0.37) CA4BBOX1CASP1TSHRFFAR3
Zinc Ion SCHEMBL7041882 0.94 CA4 (0.37) CA4BBOX1CASP1TSHRFFAR3
SCHEMBL8382399 0.94 CA4 (0.37) CA4BBOX1CASP1TSHRFFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1917332-B1 USE OF LUBRICANTS STATOIL FUEL & RETAIL LUBRICANTS SWEDEN AB (SE) 2017-06-07 EP claimed
EP-1917332-B1 USE OF LUBRICANTS STATOIL FUEL & RETAIL LUBRICANTS SWEDEN AB (SE) 2017-06-07 EP disclosed