SCHEMBL5465688

SCHEMBL5465688

N#Cc1cccc(Nc2ncnc3sc(C(=O)NC4CCN(Cc5cccs5)CC4)cc23)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.42
PRKAA2 P54646 4/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.39
MEN1 O00255 6/20 0.39
KMT2A Q03164 5/20 0.39
SIGMAR1 Q99720 1/20 0.38
GPR6 P46095 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL5465709 0.89 PRKAA2 (0.50) EGFRPRKAA2MEN1KMT2A
SCHEMBL5330700 0.87 EGFR (0.45) EGFRPRKAA2ABCG2MEN1KMT2A
SCHEMBL5462750 0.86 EGFR (0.43) EGFRPRKAA2ABCG2MEN1KMT2A
SCHEMBL5463988 0.85 EGFR (0.43) EGFRPRKAA2ABCG2MKNK2TP53
SCHEMBL5462901 0.85 DCLK1 (0.48) EGFRABCG2MKNK2TP53
SCHEMBL5463510 0.84 PRKAA2 (0.47) EGFRPRKAA2MEN1
SCHEMBL5463882 0.84 EGFR (0.54) EGFR
SCHEMBL5462805 0.83 PRKAA2 (0.42) EGFRPRKAA2ABCG2MEN1KMT2A
SCHEMBL5463029 0.81 SOS1 (0.46) EGFRMEN1KMT2A
SCHEMBL5469705 0.81 HTR2B (0.49) EGFRPRKAA2

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-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine ASTRAZENECA AB (SE) 2007-10-18 US claimed

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-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine CXCR4, CXCR1, CXCR3 EGFR 4385/4885PRKAA2 4108/4885ALDH1A1 683/4885

“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.