SCHEMBL7708104

SCHEMBL7708104

CC(C)(C)OC(=O)Oc1ccc(-c2[c]ccc(OC(C)(C)C)c2-c2ccc(OC(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.47
KDM1A O60341 1/20 0.37
CA2 P00918 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
SCHEMBL7708554 0.90 ELANE (0.47) ELANEKDM1ACA2
SCHEMBL7711588 0.84 ELANE (0.48) ELANEKDM1ACA2
SCHEMBL7711374 0.82 CA12 (0.44) ELANECA2
SCHEMBL7708620 0.80 PTGS2 (0.34) CA2
SCHEMBL7705600 0.78 SENP1 (0.34)
SCHEMBL7711577 0.77 MEN1 (0.30)
SCHEMBL7708791 0.75 ELANE (0.50) ELANEKDM1ACA2
SCHEMBL7707636 0.74 ABCB1 (0.32)
SCHEMBL4059798 0.74 ELANE (0.72) ELANEKDM1ACA2
SCHEMBL7702896 0.73 ALDH1A1 (0.32)

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-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed