SCHEMBL7585230

SCHEMBL7585230

CCOC(=O)CN(C)C1CCN(c2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)CC1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.67
ERBB2 P04626 2/20 0.67
MAPT P10636 1/20 0.67
HPGD P15428 1/20 0.51
HTT P42858 1/20 0.51
BRAF P15056 17/20 0.51

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
SCHEMBL7585703 0.91 EGFR (0.69) EGFRERBB2MAPTHPGDHTT
SCHEMBL7585269 0.90 EGFR (0.54) EGFRERBB2MAPTBRAF
SCHEMBL7587008 0.90 EGFR (0.79) EGFRERBB2MAPTHPGDHTT
SCHEMBL7583353 0.88 EGFR (0.65) EGFRERBB2MAPTHPGDHTT
SCHEMBL7582446 0.87 EGFR (0.68) EGFRERBB2MAPTHPGDHTT
SCHEMBL7574863 0.87 EGFR (0.69) EGFRERBB2MAPTHPGDHTT
SCHEMBL7587350 0.86 EGFR (0.63) EGFRERBB2MAPTHPGDHTT
SCHEMBL6992486 0.85 EGFR (0.69) EGFRERBB2MAPTHPGDHTT
SCHEMBL8316275 0.85 EGFR (0.75) EGFRERBB2MAPTHPGDHTT
SCHEMBL7585075 0.85 ERBB2 (0.67) EGFRERBB2MAPTHPGDHTT

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-20020082420-A1 Bicyclic heterocycles, pharmaceutical compositions containing them, their use, and processes for preparing them BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-06-27 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-20020082420-A1 Bicyclic heterocycles, pharmaceutical compositions containing them, their use, and processes for preparing them PKD1, REN, CYP11B1 EGFR 1041/4885ERBB2 2419/4885MAPT 1580/4885

“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.