SCHEMBL5628562

SCHEMBL5628562

CN(C)C1CCN(CCC2CCc3c(sc4ncnc(Nc5ccc(OCc6cccc(F)c6)c(Cl)c5)c34)C2)C1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.63
ERBB2 P04626 11/20 0.52
CCNA2 P20248 1/20 0.47
CDK2 P24941 1/20 0.47
CCNA1 P78396 1/20 0.47
MKNK1 Q9BUB5 1/20 0.46

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
SCHEMBL5630815 1.00 EGFR (0.63) EGFRERBB2CCNA2CDK2CCNA1
SCHEMBL5629507 1.00 EGFR (0.63) EGFRERBB2CCNA2CDK2CCNA1
SCHEMBL5629802 0.93 EGFR (0.54) EGFRERBB2CCNA2CDK2CCNA1
SCHEMBL5629813 0.91 EGFR (0.65) EGFRERBB2CCNA2CDK2CCNA1
SCHEMBL5629580 0.91 EGFR (0.65) EGFRERBB2CCNA2CDK2CCNA1
SCHEMBL5631466 0.90 EGFR (0.68) EGFRERBB2CCNA2CDK2CCNA1
SCHEMBL5630741 0.90 EGFR (0.68) EGFRERBB2CCNA2CDK2CCNA1
SCHEMBL5629204 0.90 EGFR (0.72) EGFRERBB2CCNA2CDK2CCNA1
SCHEMBL5629158 0.90 EGFR (0.71) EGFRERBB2MKNK1
SCHEMBL5632273 0.89 EGFR (0.66) EGFRERBB2CCNA2CDK2CCNA1

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
US-7238701-B2 Substituted tetrahydrobenzothienopyrimidinamine compounds useful for treating hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2007-07-03 US disclosed
US-20060293322-A1 Substituted tetrahydrobenzothienopyrimidinamine compounds useful for treating hyper-proliferative disorders BAYER PHARMACEUTICALS CORPORATION (US) 2006-12-28 US disclosed
EP-1651652-B1 SUBSTITUTED TETRAHYDROBENZOTHIENOPYRIMIDINAMINE COMPOUNDS USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS BAYER PHARMACEUTICALS CORP (US) 2006-12-27 EP 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-20060293322-A1 Substituted tetrahydrobenzothienopyrimidinamine compounds useful for treating hyper-proliferative disorders MKI67, PCNA, MYC EGFR 1499/4885ERBB2 692/4885CCNA2 9/4885

“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.