SCHEMBL8566440

SCHEMBL8566440

Cc1cn2cccc(OCCc3cc4c(cc3Cl)OCO4)c2n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 1/20 0.37
PPARG P37231 1/20 0.37
MAPT P10636 4/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HTR1A P08908 2/20 0.36
SLC6A4 P31645 2/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 3/20 0.35
NPC1 O15118 2/20 0.35
HPGD P15428 1/20 0.35
DUSP3 P51452 1/20 0.34
PTPN5 P54829 1/20 0.34
CASP6 P55212 1/20 0.34
PTPN11 Q06124 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
S1PR4 O95977 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL8565480 0.80
SCHEMBL8567203 0.78 PPARG (0.39) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL7994288 0.78 S1PR4 (0.51) PPARGMAPTALDH1A1KDM4ENPC1
SCHEMBL9748883 0.73 PTGER1 (0.44) PPARGMAPTNPSR1ALDH1A1KDM4E
SCHEMBL9747708 0.72 PPARG (0.44) PPARGMAPTALDH1A1KDM4EHPGD
SCHEMBL10649033 0.71 HRH3 (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8561996 0.71 PPARG (0.46) PPARGALDH1A1KDM4ENPC1CYP1A2
SCHEMBL8562316 0.70 HSD11B1 (0.46) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2191240 0.70 PPARG (0.67) PPARGMAPTALDH1A1NPC1CYP2D6
SCHEMBL10648674 0.70 HRH3 (0.47) MAPTMEN1KMT2ALMNACYP3A4

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