SCHEMBL4064872

SCHEMBL4064872

Cc1cc(F)ccc1Oc1ccc(NC(=O)c2ccccc2C(F)(F)F)cn1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 1/20 0.51
KCNK9 Q9NPC2 1/20 0.51
ABL1 P00519 1/20 0.48
SRC P12931 1/20 0.48

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
SCHEMBL4061558 0.89 HTR2C (0.50) KCNK3KCNK9
SCHEMBL4061450 0.88 P4HTM (0.56)
SCHEMBL30392421 0.85 RAB9A (0.46) KCNK3KCNK9
SCHEMBL4065333 0.81 HTR2C (0.48)
SCHEMBL4060887 0.81 POLB (0.49)
SCHEMBL19459590 0.79 PKM (0.60) KCNK3KCNK9ABL1SRC
SCHEMBL4063740 0.79 HTR2C (0.54) KCNK3KCNK9
SCHEMBL4058778 0.78 GAA (0.56) KCNK3KCNK9
SCHEMBL4062244 0.77 PNLIP (0.60) KCNK3KCNK9
SCHEMBL4065181 0.76 GRM4 (0.57)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1028945-B9 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2009-02-18 EP disclosed
EP-1028945-B1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2007-07-11 EP disclosed