SCHEMBL5914093

SCHEMBL5914093

CC(Cc1cccc(CNC(=O)OC(C)(C)C)c1)Nc1nccc(N(C)c2ccnc(-c3ccccc3)n2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 4/20 0.39
▸ ACACB O00763 1/20 0.39
▸ ACACA Q13085 1/20 0.39
▸ CKS1B P61024 1/20 0.39
▸ SKP1 P63208 1/20 0.39
▸ SKP2 Q13309 1/20 0.39
▸ CTSB P07858 1/20 0.39
▸ CTSS P25774 1/20 0.39
▸ CTSK P43235 1/20 0.39
▸ NAMPT P43490 2/20 0.38
▸ GLS O94925 3/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ CCKBR P32239 1/20 0.37
▸ BRD4 O60885 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ MAPK1 P28482 2/20 0.37

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
SCHEMBL5914098 1.00 MAPK14 (0.39) MAPK14ACACBACACACKS1BSKP1
SCHEMBL5914203 0.93 GRM2 (0.41) MAPK14CTSSCTSKGLSBRD4
SCHEMBL5914202 0.93 GRM2 (0.41) MAPK14CTSSCTSKGLSBRD4
SCHEMBL5914118 0.90 MAPK14 (0.42) MAPK14ALDH1A1CYP1A2CYP3A4MAPK1
SCHEMBL5914003 0.90 NAMPT (0.37) MAPK14ACACBACACACKS1BSKP1
SCHEMBL5914005 0.90 NAMPT (0.37) MAPK14ACACBACACACKS1BSKP1
SCHEMBL5914249 0.88 BRD4 (0.38) MAPK14GLSBRD4CYP3A4KDR
SCHEMBL5914251 0.88 BRD4 (0.38) MAPK14GLSBRD4CYP3A4KDR
SCHEMBL5914082 0.84 MAPK14 (0.39) MAPK14ALDH1A1CYP1A2CYP3A4MAPK1
SCHEMBL5259529 0.83 ACACB (0.36) MAPK14ACACBACACACKS1BSKP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 2620/4885ACACB 2217/4885ACACA 2863/4885

“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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