SCHEMBL21149595

SCHEMBL21149595

COc1cc(N2CCN(C)CC2)ccc1Nc1nc(Nc2ccccc2NS(C)(=O)=O)c2sccc2n1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.71
ALK Q9UM73 1/20 0.64
LRRK2 Q5S007 2/20 0.59
GSK3A P49840 1/20 0.58
MAPK15 Q8TD08 1/20 0.58
CAMKK2 Q96RR4 1/20 0.58
PTK2 Q05397 1/20 0.57

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
SCHEMBL21150067 0.94 EGFR (0.75) EGFRALKLRRK2MAPK15CAMKK2
SCHEMBL22170292 0.91 EGFR (0.72) EGFRALK
SCHEMBL19867179 0.90 ALK (0.70) EGFRALKLRRK2MAPK15CAMKK2
SCHEMBL19867176 0.87 ALK (0.68) EGFRALKLRRK2MAPK15CAMKK2
SCHEMBL21099614 0.87 ALK (0.59) EGFRALKPTK2
SCHEMBL21149588 0.86 ALK (0.72) EGFRALKLRRK2MAPK15CAMKK2
SCHEMBL19867189 0.86 ALK (0.84) EGFRALKLRRK2MAPK15CAMKK2
SCHEMBL21099428 0.86 ALK (0.60) EGFRALKPTK2
SCHEMBL21099503 0.85 ALK (0.60) EGFRALKPTK2
SCHEMBL19867372 0.85 ALK (0.71) EGFRALKLRRK2CAMKK2PTK2

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-11078213-B2 Thienopyrimidine compound, preparation method thereof, pharmaceutical composition and application thereof Hongyun Biotech Co., Ltd. (CN) 2021-08-03 US disclosed
US-20200207779-A2 THIENOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF Hongyun Biotech Co., Ltd. (CN) 2020-07-02 US disclosed
US-20190211030-A1 THIENOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF Hongyun Biotech Co., Ltd. (CN) 2019-07-11 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 (3 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-20190211030-A1 THIENOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF ALK, MET, TIE1 EGFR 105/4885ALK 1/4885LRRK2 1850/4885
US-20200207779-A2 THIENOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF ALK, MET, TIE1 EGFR 105/4885ALK 1/4885LRRK2 1850/4885
US-11078213-B2 Thienopyrimidine compound, preparation method thereof, pharmaceutical composition and application thereof ALK, MET, TIE1 EGFR 105/4885ALK 1/4885LRRK2 1850/4885

“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.