SCHEMBL6982548

SCHEMBL6982548

CC1CC[N+](O)(c2nc(-c3ccc(F)cc3)c(-c3ccnc(N[C@@H](C)c4ccccc4)n3)o2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.51
MAPK13 O15264 6/20 0.50
PRKD3 O94806 1/20 0.50
MAP4K4 O95819 1/20 0.50
LCK P06239 1/20 0.50
LYN P07948 1/20 0.50
MAPK1 P28482 1/20 0.50
AKT2 P31751 1/20 0.50
FLT4 P35916 1/20 0.50
FLT3 P36888 1/20 0.50
FRK P42685 1/20 0.50
MAPK8 P45983 1/20 0.50
MAPK9 P45984 1/20 0.50
CSNK1A1 P48729 1/20 0.50
CSNK1D P48730 1/20 0.50
GSK3A P49840 1/20 0.50
GSK3B P49841 1/20 0.50
CSNK1G2 P78368 1/20 0.50
MAP4K2 Q12851 1/20 0.50
DYRK1A Q13627 1/20 0.50

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
SCHEMBL6983093 0.82 MAPK14 (0.54) MAPK14MAPK13PRKD3MAP4K4LCK
SCHEMBL6984997 0.77 MAPK14 (0.58) MAPK14MAPK13PRKD3MAP4K4LCK
SCHEMBL27581691 0.77 MAPK14 (0.58) MAPK14MAPK13PRKD3MAP4K4LCK
SCHEMBL6983458 0.77 MAPK14 (0.56) MAPK14MAPK13PRKD3MAP4K4LCK
SCHEMBL6983433 0.76 MAPK14 (0.59) MAPK14MAPK13PRKD3MAP4K4LCK
SCHEMBL6989040 0.75 MAPK14 (0.57) MAPK14MAPK13PRKD3MAP4K4LCK
SCHEMBL6984777 0.74 MAPK14 (0.55) MAPK14MAPK13PRKD3MAP4K4LCK
SCHEMBL28747280 0.74 MAPK14 (0.55) MAPK14MAPK13PRKD3MAP4K4LCK
SCHEMBL6987449 0.73 MAPK14 (0.53) MAPK14MAPK13PRKD3MAP4K4LCK
SCHEMBL6987037 0.72 MAPK13 (0.49) MAPK14MAPK13PRKD3MAP4K4LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1224180-B1 SUBSTITUTED AZOLES NOVARTIS AG (CH) 2003-07-02 EP claimed
US-6579874-B2 P38 MAP kinase inhibitors; treating Tumor necrosis factor (TNF-alpha) and Interleukin-1 mediated diseases, such as rheumatoid arthritis; imidazole and oxazole derivatives NOVARTIS AG (CH) 2003-06-17 US claimed
US-20020049220-A1 Substituted azoles NOVARTIS AG (CH) 2002-04-25 US claimed
EP-1224180-B1 SUBSTITUTED AZOLES NOVARTIS AG (CH) 2003-07-02 EP disclosed
US-6579874-B2 P38 MAP kinase inhibitors; treating Tumor necrosis factor (TNF-alpha) and Interleukin-1 mediated diseases, such as rheumatoid arthritis; imidazole and oxazole derivatives NOVARTIS AG (CH) 2003-06-17 US disclosed
US-20020049220-A1 Substituted azoles NOVARTIS AG (CH) 2002-04-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020049220-A1 Substituted azoles MAPK1, MAPK4, MAP3K1 MAPK14 21/4885MAPK13 15/4885PRKD3 653/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.