SCHEMBL8569164

SCHEMBL8569164

COc1ccc(CCNC(=O)OC(C)(C)C)cc1OC1CCCC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
EPHX1 P07099 1/20 0.55
PDE4B Q07343 9/20 0.52
PDE4A P27815 2/20 0.52
PDE4C Q08493 2/20 0.52
PDE4D Q08499 2/20 0.52
ALDH1A1 P00352 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
APOBEC3A P31941 1/20 0.48
HTT P42858 1/20 0.48
APOBEC3G Q9HC16 1/20 0.48

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
SCHEMBL9268912 0.93 MEN1 (0.49) KMT2AMEN1EPHX1PDE4BPDE4A
SCHEMBL8569827 0.93 PDE4B (0.52) KMT2AMEN1EPHX1PDE4BPDE4A
SCHEMBL31432851 0.86 CA12 (0.64) KMT2AMEN1ALDH1A1CA12CA1
SCHEMBL903446 0.86 CA12 (0.64) KMT2AMEN1ALDH1A1CA12CA1
SCHEMBL8571660 0.85 KMT2A (0.61) KMT2AMEN1EPHX1PDE4BPDE4A
SCHEMBL8570021 0.85 MEN1 (0.61) KMT2AMEN1EPHX1PDE4BPDE4A
SCHEMBL7361467 0.83 MEN1 (0.58) KMT2AMEN1EPHX1PDE4BPDE4A
SCHEMBL7396306 0.83 MEN1 (0.58) KMT2AMEN1EPHX1PDE4BPDE4A
SCHEMBL8571467 0.83 MEN1 (0.58) KMT2AMEN1EPHX1PDE4BPDE4A
SCHEMBL6816260 0.83 KMT2A (0.58) KMT2AMEN1EPHX1PDE4BPDE4A

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
US-5710180-A TREATING ALLERGIC AND INFLAMMATORY DISEASES SMITHKLINE BEECHAM CORPORATION (US) 1998-01-20 US disclosed