SCHEMBL9608082

SCHEMBL9608082

COC(=O)CCCCC[C@@H](COC(=O)Nc1cc2ccncc2cn1)N(C)C(=O)NCc1cccc(F)c1Cl

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 1/20 0.31
DGAT2 Q96PD7 2/20 0.30

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
SCHEMBL2726553 0.97 MAP4K1 (0.31) MAP4K1DGAT2
SCHEMBL2726566 0.95 MAP4K1 (0.31) MAP4K1DGAT2
SCHEMBL2723614 0.92 MAP4K1 (0.32) MAP4K1DGAT2
SCHEMBL212091 0.91 MAP4K1 (0.33) MAP4K1DGAT2
SCHEMBL213616 0.91 MAP4K1 (0.34) MAP4K1DGAT2
SCHEMBL213615 0.91 MAP4K1 (0.34) MAP4K1DGAT2
SCHEMBL213614 0.91 MAP4K1 (0.34) MAP4K1DGAT2
SCHEMBL2722343 0.90 CTSK (0.36)
SCHEMBL212268 0.89 MAP4K1 (0.33) MAP4K1
SCHEMBL2723892 0.88 MAP4K1 (0.34) MAP4K1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759374-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2014-06-24 US disclosed
US-20120135964-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS QIAN XIANGPING (US) 2012-05-31 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-20120135964-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS MYLK, MYH2, MYH10 MAP4K1 1290/4885DGAT2 4413/4885

“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.