SCHEMBL4063185

SCHEMBL4063185

Cc1cc(Cl)cc(C)c1Oc1ccc(NC(=O)c2c(Cl)cccc2Cl)cn1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.54
TYK2 P29597 11/20 0.48
JAK2 O60674 8/20 0.48
JAK1 P23458 5/20 0.48
ABL1 P00519 2/20 0.47
SRC P12931 2/20 0.47
GRM8 O00222 1/20 0.47
GRM7 Q14831 1/20 0.47
GRM4 Q14833 1/20 0.47
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CYP3A4 P08684 1/20 0.44

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
SCHEMBL4061085 0.92 POLB (0.50) POLBTYK2ABL1SRCGRM8
SCHEMBL4061697 0.87 GRM8 (0.55) POLBTYK2JAK2JAK1GRM8
SCHEMBL4061467 0.84 POLB (0.53) POLBTYK2JAK2JAK1ABL1
SCHEMBL4060750 0.82 POLB (0.50) POLBTYK2JAK2JAK1ABL1
SCHEMBL4060887 0.81 POLB (0.49) POLBGRM8GRM7GRM4
SCHEMBL4062838 0.81 MAPT (0.56) POLBTYK2JAK2JAK1GRM8
SCHEMBL4061768 0.80 HTR2C (0.62)
SCHEMBL4058614 0.79 GRM8 (0.53) POLBGRM8GRM7GRM4
SCHEMBL4062046 0.77 MAPT (0.54) POLB
SCHEMBL4060261 0.76 POLB (0.48) POLBTYK2JAK2JAK1ABL1

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