SCHEMBL2855928

SCHEMBL2855928

Nc1cc(Oc2ccc(NC(=O)C(Cl)(Cl)Cl)c(F)c2)ccn1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 8/20 0.62
▸ BRAF P15056 6/20 0.50
▸ MET P08581 6/20 0.46
▸ MAPK13 O15264 2/20 0.44
▸ KDR P35968 5/20 0.43
▸ RIPK2 O43353 1/20 0.43
▸ ABCB11 O95342 1/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ RAF1 P04049 1/20 0.43
▸ NR3C1 P04150 1/20 0.43
▸ RET P07949 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ PDGFRB P09619 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.43
▸ KIT P10721 1/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ BCR P11274 1/20 0.43
▸ FGFR1 P11362 1/20 0.43
▸ RARG P13631 1/20 0.43
▸ PDGFRA P16234 1/20 0.43

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
SCHEMBL2854954 0.89 MAPK14 (0.60) MAPK14BRAFMETMAPK13KDR
SCHEMBL1136971 0.88 MAPK14 (0.65) MAPK14BRAFMETMAPK13KDR
SCHEMBL2860620 0.86 RAF1 (0.50) MAPK14BRAFMAPK13KDRRIPK2
SCHEMBL3561767 0.85 MAPK14 (0.61) MAPK14BRAFMETMAPK13KDR
SCHEMBL2858354 0.81 MAPK14 (0.63) MAPK14BRAFMETMAPK13KDR
SCHEMBL12812041 0.81 MAPK14 (0.51) MAPK14BRAFMETKDRRAF1
SCHEMBL4321614 0.77 MET (0.72) MAPK14BRAFMETRAF1
SCHEMBL23201734 0.77 MAPK14 (1.00) MAPK14BRAFMAPK13KDRRIPK2
SCHEMBL29844389 0.77 MAPK14 (1.00) MAPK14BRAFMAPK13KDRRIPK2
SCHEMBL13635346 0.77 MAPK14 (0.52) MAPK14BRAFMETKDRRIPK2

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 1722/4885MET 691/4885

“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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