SCHEMBL6079858

SCHEMBL6079858

CC(C)(C)OC(=O)Nc1ccc(F)c(COc2cnccn2)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.45
NAMPT P43490 1/20 0.43
CYP17A1 P05093 5/20 0.42
KMT2A Q03164 1/20 0.40
F10 P00742 1/20 0.38
RORC P51449 1/20 0.37
MAPKAPK2 P49137 2/20 0.37
EGFR P00533 1/20 0.37
AURKB Q96GD4 1/20 0.37
GPR119 Q8TDV5 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA9 Q16790 1/20 0.36
MAP4K4 O95819 1/20 0.36
RXRA P19793 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
ANO1 Q5XXA6 1/20 0.36

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
SCHEMBL6079886 0.82 RAB9A (0.51) NAMPTKMT2A
SCHEMBL6079669 0.82 HDAC3 (0.43) NAMPTKMT2A
SCHEMBL6079540 0.81 HTR2C (0.35) SYKKMT2AGPR119RXRAGRIN1
SCHEMBL6079210 0.81 SIRT2 (0.51) SYKNAMPTCYP17A1
SCHEMBL6078849 0.79 BRAF (0.48) KMT2A
SCHEMBL6078955 0.79 CA12 (0.45) SYKNAMPTCYP17A1RORCMAPKAPK2
SCHEMBL6080568 0.77 KMT2A (0.48) KMT2A
SCHEMBL22941793 0.75 CA12 (0.44) SYKCYP17A1RORCCA12CA1
SCHEMBL13244160 0.75 CA12 (0.44) SYKNAMPTCYP17A1RORCMAPKAPK2
SCHEMBL6079909 0.75 MAPK14 (0.56)

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
US-20060063782-A1 3-Hetero arylmethoxy ! pyridines and their analogues as p38 map kinase inhibitors ASTEX THERAPEUTICS LIMITED (GB) 2006-03-23 US disclosed
WO-2005002673-A1 RAF KINASE INHIBITORS ASTEX THERAPEUTICS LIMITED (GB) 2005-01-13 WO 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-20060063782-A1 3-Hetero arylmethoxy ! pyridines and their analogues as p38 map kinase inhibitors MAPK1, MAPK3, MAPK10 SYK 1316/4885NAMPT 1734/4885CYP17A1 2139/4885

“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.