SCHEMBL2401609

SCHEMBL2401609

CCC(CCCC(=O)[O-])(OC(C)C)C(=O)[O-].CCC(CCCC(=O)[O-])(OC(C)C)C(=O)[O-].[Ti+4]

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.37
BBOX1 O75936 3/20 0.36
NFKB1 P19838 1/20 0.33
FFAR3 O14843 2/20 0.32
HDAC3 O15379 2/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC2 Q92769 2/20 0.32
HDAC8 Q9BY41 2/20 0.32
FABP3 P05413 5/20 0.31
CA2 P00918 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
SCHEMBL10455448 0.73 CA4 (0.32) CA2
SCHEMBL9418536 0.70 CA1 (0.41) CA1BBOX1FFAR3HDAC3HDAC1
SCHEMBL28364549 0.67 CA2 (0.30) CA2
SCHEMBL2454766 0.66
SCHEMBL30592615 0.65 CA1 (0.41) CA1BBOX1NFKB1FFAR3HDAC3
Isopropyl Alcohol SCHEMBL27552941 0.65 CA1 (0.41) CA1BBOX1NFKB1FFAR3HDAC3
SCHEMBL2058733 0.64 CA2 (0.30) CA2
SCHEMBL8468851 0.63 FFAR3 (0.34) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL6553769 0.63 CA1 (0.65) CA1BBOX1NFKB1FFAR3HDAC3
SCHEMBL21049962 0.63 CA1 (0.65) CA1BBOX1NFKB1FFAR3HDAC3

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
US-8518626-B2 Carrier, method for preparing the carrier, developer using the carrier, developer container, and image forming method and apparatus and process cartridge using the developer RICOH COMPANY, LIMITED (JP) 2013-08-27 US disclosed
US-20110229817-A1 CARRIER, METHOD FOR PREPARING THE CARRIER, DEVELOPER USING THE CARRIER, DEVELOPER CONTAINER, AND IMAGE FORMING METHOD AND APPARATUS AND PROCESS CARTRIDGE USING THE DEVELOPER RICOH COMPANY LIMITED (JP) 2011-09-22 US disclosed