SCHEMBL8566754

SCHEMBL8566754

FC(F)(F)c1cn2cccc(OCc3c(Cl)cccc3Cl)c2n1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.44
PPARG P37231 1/20 0.41
PKM P14618 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL8562316 0.81 HSD11B1 (0.46) HSD11B1PPARGCYP1A2CYP3A4CYP2D6
SCHEMBL8558939 0.79 HSD11B1 (0.45) HSD11B1PPARGPKMCYP1A2CYP3A4
Hydrochloric Acid SCHEMBL9276910 0.77 PPARG (0.54) HSD11B1PPARGPKMSMN1; SMN2
SCHEMBL8561187 0.76 KMT2A (0.42) PPARGCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL8567297 0.76 HSD11B1 (0.49) HSD11B1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2171037 0.74 PDE4B (0.42) CYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL9076921 0.74 PPARG (0.41) HSD11B1PPARGCYP1A2CYP3A4CYP2D6
SCHEMBL8564199 0.73 MAPT (0.51) CYP1A2
SCHEMBL8563420 0.72 PPARG (0.46) PPARG
SCHEMBL8561996 0.72 PPARG (0.46) PPARGCYP1A2CYP3A4CYP2D6CYP2C9

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