SCHEMBL19203857

SCHEMBL19203857

CP(C)(=O)c1ccc(Nc2ncc(Cl)c(Nc3ccccc3[SH](=O)=O)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 7/20 0.56
▸ INSR P06213 6/20 0.56
▸ IGF1R P08069 6/20 0.56
▸ CCNA2 P20248 1/20 0.51
▸ CDK2 P24941 1/20 0.51
▸ PTK2 Q05397 8/20 0.50
▸ MAPK9 P45984 3/20 0.50
▸ MAPK10 P53779 3/20 0.50
▸ AURKA O14965 1/20 0.50

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
SCHEMBL15217781 0.86 ALK (0.62) ALKINSRIGF1RCCNA2CDK2
SCHEMBL16656851 0.84 INSR (0.60) ALKINSRIGF1RAURKA
SCHEMBL11916403 0.84 JAK2 (0.63) ALKINSRIGF1RCCNA2CDK2
SCHEMBL15217784 0.83 ALK (0.82) ALKINSRIGF1RAURKA
SCHEMBL21446901 0.82 CCNA2 (0.48) ALKINSRCCNA2CDK2PTK2
SCHEMBL19203805 0.81 ALK (0.53) ALKINSRIGF1RCCNA2CDK2
SCHEMBL11916315 0.81 ALK (0.53) ALKINSRIGF1RCCNA2CDK2
SCHEMBL11901091 0.80 ALK (0.73) ALKINSRIGF1RPTK2
SCHEMBL19203872 0.77 LRRK2 (0.69) ALKINSRIGF1RPTK2MAPK9
SCHEMBL15424352 0.75 ALK (0.41) ALKIGF1RCCNA2CDK2MAPK9

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-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. 2017-08-03 — — 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-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 ALK 256/4885INSR 941/4885IGF1R 526/4885

“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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