SCHEMBL5314959

SCHEMBL5314959

C[C@@H](Cc1cccc(CNC(=O)O)c1)Nc1nccc(N(C)c2ccnc(-c3ccccc3F)n2)n1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 14/20 0.40
▸ KDR P35968 3/20 0.37
▸ ALDH1A1 P00352 1/20 0.35

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
SCHEMBL5314967 1.00 MAPK14 (0.40) MAPK14KDRALDH1A1
SCHEMBL5913877 0.92 MAPK14 (0.38) MAPK14KDR
SCHEMBL5913871 0.92 MAPK14 (0.38) MAPK14KDR
SCHEMBL5914210 0.91 MAPK14 (0.38) MAPK14KDRALDH1A1
SCHEMBL5914204 0.91 MAPK14 (0.38) MAPK14KDRALDH1A1
SCHEMBL5914118 0.89 MAPK14 (0.42) MAPK14KDRALDH1A1
SCHEMBL5914082 0.88 MAPK14 (0.39) MAPK14KDRALDH1A1
SCHEMBL5914162 0.87 HPGDS (0.40) MAPK14KDRALDH1A1
SCHEMBL5914169 0.87 HPGDS (0.40) MAPK14KDRALDH1A1
SCHEMBL5913875 0.84 KDR (0.38) MAPK14KDR

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 2620/4885KDR 210/4885ALDH1A1 3019/4885

“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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