SCHEMBL10697335

SCHEMBL10697335

N#Cc1ccc(Oc2c(Cl)cc(C(F)(F)F)cc2Cl)nc1OCC(=O)Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.37
PDE4A P27815 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
RECQL P46063 1/20 0.37
CNR1 P21554 1/20 0.36
MRGPRX4 Q96LA9 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 3/20 0.35
KDM4E B2RXH2 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
XBP1 P17861 1/20 0.35
FFAR1 O14842 1/20 0.35
AR P10275 3/20 0.34
GPR119 Q8TDV5 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
SCHEMBL10698723 0.92 PTGDR2 (0.41) PDE4BPDE4APDE4CPDE4DCYP1A2
SCHEMBL10698183 0.68 KMT2A (0.37) CYP1A2CYP2C19SMN1; SMN2MAPTKDM4E
SCHEMBL11856899 0.67 AR (0.53) AR
SCHEMBL10443317 0.67 AR (0.47) AR
SCHEMBL10444431 0.67 PGR (0.41) MAPTKDM4EFFAR1ARLMNA
SCHEMBL11447794 0.66 PPARA (0.43) CYP1A2CYP2C19MRGPRX4MAPTAR
SCHEMBL11855441 0.65 AR (0.55) AR
SCHEMBL10443484 0.65 PGR (0.40) CYP1A2CYP2C9CYP2C19MAPTKDM4E
SCHEMBL10444566 0.65 PGR (0.40) FFAR1ARLMNA
SCHEMBL11447793 0.65 FFAR1 (0.40) SMN1; SMN2FFAR1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0272533-A2 Substituted phenoxypyridines BAYER AG (DE) 1988-06-29 EP disclosed