SCHEMBL8566849

SCHEMBL8566849

Cc1cn2cccc(OCc3c(Cl)cc(C(=O)c4ccccc4)cc3Cl)c2n1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.40
ATM Q13315 1/20 0.37
BDKRB2 P30411 2/20 0.37
MRGPRX4 Q96LA9 1/20 0.36
ATP4A P20648 1/20 0.36
ATP4B P51164 1/20 0.36

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
SCHEMBL8562739 0.88 PTGER1 (0.41) PPARGATM
SCHEMBL8561996 0.84 PPARG (0.46) PPARGBDKRB2
SCHEMBL8562316 0.81 HSD11B1 (0.46) PPARGBDKRB2
SCHEMBL8563624 0.81 BDKRB2 (0.41) BDKRB2
Hydrochloric Acid SCHEMBL8666495 0.80 BDKRB2 (0.42) BDKRB2
SCHEMBL8559191 0.80 BDKRB2 (0.56) BDKRB2
SCHEMBL8563420 0.77 PPARG (0.46) PPARG
SCHEMBL8672788 0.77 BDKRB2 (0.45) BDKRB2
Hydrochloric Acid SCHEMBL8666531 0.76 BDKRB2 (0.46) BDKRB2
SCHEMBL8562786 0.76 PPARG (0.40) PPARGBDKRB2

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