SCHEMBL8565095

SCHEMBL8565095

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ccc(Cl)c(CBr)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
MT-CO2 P00403 1/20 0.31
AKT1 P31749 1/20 0.31
AAK1 Q2M2I8 1/20 0.30

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
SCHEMBL6490662 0.78 CYP4F2 (0.42) CYP4F2CYP4A11AKT1
SCHEMBL18298939 0.75 CYP4F2 (0.38) CYP4F2CYP4A11
SCHEMBL18300644 0.74 SSTR4 (0.34) AAK1
SCHEMBL16529032 0.73 CYP4F2 (0.43) CYP4F2CYP4A11
SCHEMBL30896676 0.72 KMT2A (0.36) MT-CO2AKT1
SCHEMBL15755068 0.72 AAK1 (0.41) AAK1
SCHEMBL6962533 0.72 FSCN1 (0.50) CYP4F2CYP4A11
SCHEMBL21079102 0.71 MT-CO2 (0.32) MT-CO2AAK1
SCHEMBL29069653 0.71 SSTR4 (0.32) MT-CO2
SCHEMBL8562693 0.70 FSCN1 (0.33) CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596406-B1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1998-12-16 EP disclosed
US-5750699-A HALOGENATING OF CORRESPONDING COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed
US-5574042-A ANTAGONIST FOR BRADYKININS AS ANTIALLERGENS, AUTOIMMUNE DISEASES, ANTIINFLAMMATORY AGENTS, SHOCK OR PAIN FUJISAWA PHARMACEUTICAL CO., LTD (JP) 1996-11-12 US disclosed
EP-0596406-A1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 EP disclosed