SCHEMBL14035440

SCHEMBL14035440

CC(OC(C)(C)C)C(=O)C(C)(C)C(C)(C)OCC(CC(=O)Nc1ccccc1S(=O)(=O)O)C(=O)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.35
CA2 P00918 6/20 0.35
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL13768015 0.85 CA1 (0.37) CA1CA2POLBKDM4EALDH1A1
SCHEMBL13768301 0.80 KDM4E (0.36) CA1CA2POLBKDM4EALDH1A1
SCHEMBL13767938 0.78 ALDH1A1 (0.35) CA1CA2KDM4EALDH1A1HSD17B10
SCHEMBL13844187 0.77 HDAC3 (0.36) KDM4EALDH1A1HSD17B10
SCHEMBL13767997 0.76 CD40 (0.39)
SCHEMBL14035410 0.74
SCHEMBL12141481 0.74 CA1 (0.37) CA1CA2POLBKDM4EALDH1A1
SCHEMBL13844188 0.74 POLB (0.38) CA1CA2POLBKDM4EALDH1A1
SCHEMBL13768022 0.73 CA1 (0.33) CA1CA2POLBKDM4EALDH1A1
SCHEMBL13767940 0.73 KMT2A (0.35) ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1774410-B1 CHARGE CONTROL AGENT, TONER, IMAGE FORMING METHOD, AND IMAGE FORMING APPARATUS CANON KK (JP) 2008-11-19 EP disclosed