SCHEMBL2858354

SCHEMBL2858354

CC(C)(C)OC(=O)Nc1ccc(Oc2ccnc(N)c2)cc1F

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 8/20 0.63
▸ BRAF P15056 4/20 0.48
▸ CYP17A1 P05093 1/20 0.47
▸ MAPK13 O15264 3/20 0.47
▸ KDR P35968 5/20 0.46
▸ MET P08581 3/20 0.45
▸ ABL1 P00519 1/20 0.45
▸ FLT1 P17948 1/20 0.45

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
SCHEMBL22919876 0.91 MAPK14 (0.52) MAPK14BRAFKDRMETFLT1
SCHEMBL16895218 0.87 MAPK14 (0.53) MAPK14BRAFCYP17A1MAPK13KDR
SCHEMBL30729902 0.87 MAPK14 (0.53) MAPK14BRAFCYP17A1MAPK13KDR
SCHEMBL2865557 0.87 ABL1 (0.52) MAPK14BRAFCYP17A1MAPK13KDR
SCHEMBL24037398 0.86 MAPK14 (0.48) MAPK14BRAFCYP17A1MAPK13KDR
SCHEMBL1136971 0.86 MAPK14 (0.65) MAPK14BRAFMAPK13KDRMET
SCHEMBL29834707 0.85 ABL1 (0.51) MAPK14BRAFCYP17A1MAPK13KDR
SCHEMBL107558 0.85 MET (0.48) MAPK14BRAFCYP17A1KDRMET
SCHEMBL29834756 0.85 ABL1 (0.53) MAPK14BRAFCYP17A1MAPK13KDR
SCHEMBL30729882 0.84 MAPK14 (0.46) MAPK14BRAFCYP17A1MAPK13KDR

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
US-20100311972-A1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-12-09 — — US disclosed
US-20100311972-A1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-12-09 — — US disclosed
US-20100311972-A1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-12-09 — — US disclosed
EP-2248810-A1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2010-11-10 — — EP disclosed
EP-2248810-A1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2010-11-10 — — EP disclosed
WO-2009104520-A1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) 2009-08-27 — — 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-20100311972-A1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE TET2, QDPR, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 MAPK14 1986/4885BRAF 1722/4885CYP17A1 1604/4885

“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.

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