SCHEMBL16580780

SCHEMBL16580780

CC(=O)Nc1ccc(Nc2ncc3ccn(Cc4ccccc4N(C)S(C)(=O)=O)c3n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 13/20 0.48
▸ JAK2 O60674 14/20 0.48
▸ PTK2B Q14289 1/20 0.47
▸ STAT6 P42226 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ JAK3 P52333 10/20 0.43
▸ TYK2 P29597 3/20 0.43
▸ AURKA O14965 1/20 0.43
▸ DCLK1 O15075 1/20 0.43
▸ PDPK1 O15530 1/20 0.43
▸ ROCK2 O75116 1/20 0.43
▸ PRKD3 O94806 1/20 0.43
▸ MAP4K4 O95819 1/20 0.43
▸ EGFR P00533 1/20 0.43
▸ NTRK1 P04629 1/20 0.43
▸ PRKCG P05129 1/20 0.43
▸ LCK P06239 1/20 0.43
▸ FYN P06241 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ LYN P07948 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
SCHEMBL16570503 0.92 PTK2 (0.51) PTK2JAK2JAK3TYK2AURKA
SCHEMBL16570256 0.90 PTK2 (0.48) PTK2JAK2PTK2BSTAT6JAK3
SCHEMBL16580858 0.89 PTK2 (0.45) PTK2JAK2PTK2BSTAT6JAK3
SCHEMBL16581005 0.89 PTK2 (0.51) PTK2JAK2PTK2BSTAT6JAK3
SCHEMBL16570229 0.89 PTK2 (0.51) PTK2JAK2PTK2BSTAT6JAK3
SCHEMBL16570232 0.88 PTK2 (0.50) PTK2JAK2PTK2BSTAT6JAK3
SCHEMBL16570555 0.88 PTK2 (0.62) PTK2JAK2PTK2BSTAT6JAK3
SCHEMBL16570531 0.88 PTK2 (0.53) PTK2JAK2PTK2BJAK3SRPK1
SCHEMBL16570577 0.87 CDK4 (0.48) PTK2JAK2PTK2BJAK3TYK2
SCHEMBL16570345 0.85 JAK2 (0.54) PTK2JAK2STAT6JAK3AURKA

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-20160222014-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS ASANA BIOSCIENCES, LLC (US) 2016-08-04 — — US disclosed
WO-2015038417-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS ASANA BIOSCIENCES, LLC (US) 2015-03-19 — — 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-20160222014-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS SRC, PTK2, FYN PTK2 2/4885JAK2 9/4885PTK2B 13/4885

“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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