SCHEMBL7708759

SCHEMBL7708759

CC(C)(C)OC(=O)c1ccc(Cc2ccc(C(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.52
▸ CA12 O43570 2/20 0.51
▸ CA1 P00915 2/20 0.51
▸ CA2 P00918 2/20 0.51
▸ CA9 Q16790 2/20 0.51
▸ CA14 Q9ULX7 2/20 0.51
▸ ELANE P08246 3/20 0.47
▸ LMNA P02545 1/20 0.46
▸ CYP17A1 P05093 1/20 0.44
▸ SLC7A5 Q01650 1/20 0.44
▸ LOXL2 Q9Y4K0 1/20 0.44
▸ SIRT2 Q8IXJ6 1/20 0.44
▸ SIRT1 Q96EB6 1/20 0.44
▸ GABRA1 P14867 1/20 0.42
▸ GABRG2 P18507 1/20 0.42
▸ GABRB3 P28472 1/20 0.42
▸ GABRA3 P34903 1/20 0.42
▸ GABRA2 P47869 1/20 0.42
▸ SRD5A2 P31213 2/20 0.42
▸ PLK1 P53350 1/20 0.41

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
SCHEMBL7588248 0.88 ALDH1A1 (0.55) KMT2ACA12CA1CA2CA9
SCHEMBL109451 0.87 CA1 (0.61) CA12CA1CA2CA9CA14
SCHEMBL1019092 0.86 CA1 (0.50) KMT2ACA12CA1CA2CA9
SCHEMBL7385067 0.86 CA1 (0.50) KMT2ACA12CA1CA2CA9
SCHEMBL16617577 0.86 CA1 (0.50) KMT2ACA12CA1CA2CA9
SCHEMBL1919683 0.85 CA1 (0.50) KMT2ACA12CA1CA2CA9
SCHEMBL18182636 0.85 THRA (0.54) KMT2ACA12CA1CA2CA9
SCHEMBL7588242 0.85 CA1 (0.49) KMT2ACA12CA1CA2CA9
SCHEMBL21580234 0.85 CA1 (0.49) KMT2ACA12CA1CA2CA9
SCHEMBL422913 0.85 LOXL2 (0.65) KMT2ACA12CA1CA2CA9

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
Send feedback