SCHEMBL7436712

SCHEMBL7436712

[CH2]C(=O)CCCCNC(=O)OC(C)(C)C

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.66
MEN1 O00255 1/20 0.57
GAA P10253 1/20 0.57
KMT2A Q03164 1/20 0.57
MAOA P21397 1/20 0.57
MAOB P27338 1/20 0.57
CA1 P00915 9/20 0.54
CA2 P00918 9/20 0.54
CA12 O43570 6/20 0.54
CA9 Q16790 6/20 0.54
CYP3A4 P08684 1/20 0.47
EPHX1 P07099 1/20 0.43
CHRM2 P08172 2/20 0.43
CHRM4 P08173 2/20 0.43
CHRM5 P08912 2/20 0.43
CHRM1 P11229 2/20 0.43
CHRM3 P20309 2/20 0.43
HTT P42858 1/20 0.42

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
SCHEMBL7426739 0.94 TDP1 (0.62) TDP1MEN1GAAKMT2AMAOA
SCHEMBL7434241 0.89 TDP1 (0.59) TDP1MEN1GAAKMT2AMAOA
SCHEMBL3020258 0.88 TDP1 (0.81) TDP1MEN1GAAKMT2AMAOA
SCHEMBL21680497 0.87 TDP1 (0.68) TDP1MEN1GAAKMT2AMAOA
SCHEMBL30958391 0.87 TDP1 (0.68) TDP1MEN1GAAKMT2AMAOA
SCHEMBL134329 0.86 TDP1 (0.85) TDP1MEN1GAAKMT2AMAOA
SCHEMBL5162656 0.86 TDP1 (0.85) TDP1MEN1GAAKMT2AMAOA
SCHEMBL3025184 0.86 TDP1 (0.85) TDP1MEN1GAAKMT2AMAOA
SCHEMBL137629 0.86 TDP1 (0.85) TDP1MEN1GAAKMT2AMAOA
SCHEMBL136815 0.86 TDP1 (0.85) TDP1MEN1GAAKMT2AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0702013-B1 Imidazopyridines MERCK PATENT GMBH (DE) 2001-06-13 EP disclosed
US-5684015-A ANGIOTENSIN ANTAGONIST AS HYPOTENSIVE AGENTS AND CARDIOVASCULAR DISORDERS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-11-04 US disclosed
CN-1129702-A Imidazopyridines MERCK PATENT GMBH (DE) 1996-08-28 CN disclosed
EP-0702013-A2 Imidazopyridines MERCK PATENT GmbH (DE) 1996-03-20 EP disclosed
US-5476857-A Imidazopyridines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-12-19 US disclosed
US-5438063-A Hypotensive agents, cardiac insufficiency, increased intraocular pressure, and CNS disorders MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-08-01 US disclosed
EP-0657454-A1 Imidazopyridazines being angiotensin II antagonists MERCK PATENT GmbH (DE) 1995-06-14 EP disclosed
EP-0628556-A1 Imidazopyridines MERCK PATENT GmbH (DE) 1994-12-14 EP disclosed