SCHEMBL5317821

SCHEMBL5317821

CC(Cc1cccc(CNC(=O)O)c1)Nc1nccc(N(C)c2nc(-c3ccccc3)ncc2F)n1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 12/20 0.39
▸ HPGDS O60760 2/20 0.37
▸ DYRK1B Q9Y463 1/20 0.36
▸ KDR P35968 3/20 0.36
▸ FGFR3 P22607 1/20 0.35
▸ SYK P43405 1/20 0.34
▸ KCNA5 P22460 1/20 0.34

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
SCHEMBL5914210 0.92 MAPK14 (0.38) MAPK14DYRK1BKDRKCNA5
SCHEMBL5914204 0.92 MAPK14 (0.38) MAPK14DYRK1BKDRKCNA5
SCHEMBL5914005 0.91 NAMPT (0.37) MAPK14HPGDSDYRK1B
SCHEMBL5914003 0.91 NAMPT (0.37) MAPK14HPGDSDYRK1B
SCHEMBL5914399 0.89 MAPK14 (0.36) MAPK14KDR
SCHEMBL5914118 0.89 MAPK14 (0.42) MAPK14KDRSYK
SCHEMBL5914222 0.88 DYRK1B (0.38) MAPK14DYRK1BKDRSYK
SCHEMBL5914082 0.85 MAPK14 (0.39) MAPK14KDR
SCHEMBL5914162 0.85 HPGDS (0.40) MAPK14HPGDSKDRSYKKCNA5
SCHEMBL5914169 0.85 HPGDS (0.40) MAPK14HPGDSKDRSYKKCNA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1794135-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-06-13 — — EP disclosed
WO-2006037117-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2006-04-06 — — WO disclosed
US-20060069110-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2006-03-30 — — 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-20060069110-A1 Substituted heterocyclic compounds and methods of use MAPT, MYLK2, IAPP MAPK14 2620/4885HPGDS 544/4885DYRK1B 2594/4885

“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.

Send feedback