SCHEMBL7435200

SCHEMBL7435200

[CH2]C(=O)N(C)C(C)(C)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.57
CYP2C19 P33261 2/20 0.57
HIF1A Q16665 2/20 0.57
LMNA P02545 2/20 0.57
CYP2D6 P10635 2/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
ALOX15 P16050 1/20 0.57
TSHR P16473 1/20 0.57
SCN1A P35498 1/20 0.57
SCN2A Q99250 1/20 0.57
SCN3A Q9NY46 1/20 0.57
NPY5R Q15761 1/20 0.54
ALDH1A1 P00352 1/20 0.45
CYP2C9 P11712 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
RIPK1 Q13546 2/20 0.42
SLC6A2 P23975 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
NPC1 O15118 3/20 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
SCHEMBL7435206 0.84 CYP3A4 (0.59) CYP3A4CYP2C19HIF1ALMNACYP2D6
SCHEMBL9234745 0.79 KMT2A (0.62) CYP3A4CYP2C19HIF1ALMNACYP2D6
SCHEMBL6137883 0.74 TAAR1 (0.54) CYP3A4CYP2C19HIF1ALMNACYP2D6
SCHEMBL4420650 0.74 MEN1 (0.46) CYP3A4CYP2C19HIF1ALMNACYP2D6
Oxethazaine SCHEMBL24489 0.73 KMT2A (1.00) CYP3A4CYP2C19HIF1ALMNACYP2D6
Oxethazaine SCHEMBL4280369 0.73 KMT2A (1.00) CYP3A4CYP2C19HIF1ALMNACYP2D6
SCHEMBL424806 0.73 HIF1A (0.48) CYP3A4CYP2C19HIF1ALMNACYP2D6
Oxethazaine SCHEMBL945710 0.72 MEN1 (0.97) CYP3A4CYP2C19HIF1ALMNACYP2D6
SCHEMBL31468672 0.72 LMNA (0.48) CYP3A4CYP2C19HIF1ALMNACYP2D6
SCHEMBL2310726 0.71 MEN1 (0.49) CYP3A4CYP2C19HIF1ALMNACYP2D6

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 10 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
CN-1109057-A Imidazopyridazine MERCK PATENT GMBH (DE) 1995-09-27 CN 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
EP-0574846-A2 Imidazopyridines as angiotensin II antagonistes MERCK PATENT GmbH (DE) 1993-12-22 EP disclosed