SCHEMBL7585306

SCHEMBL7585306

CCOC(=O)CN1CCC(N(C)c2ncc3ncnc(Nc4cccc(C)c4)c3n2)CC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.56
BRAF P15056 8/20 0.46
HPGD P15428 1/20 0.41
MAP4K4 O95819 1/20 0.39
PIK3CD O00329 1/20 0.39

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
SCHEMBL7578811 0.92 EGFR (0.56) EGFRBRAF
SCHEMBL7578325 0.92 EGFR (0.46) EGFRBRAFHPGDPIK3CD
SCHEMBL7578315 0.90 BRAF (0.45) EGFRBRAF
SCHEMBL7576180 0.85 EGFR (0.58) EGFRBRAF
SCHEMBL7585329 0.83 EGFR (0.56) EGFRBRAFHPGD
SCHEMBL8316432 0.81 EGFR (0.69) EGFRBRAF
SCHEMBL8316426 0.81 EGFR (0.69) EGFRBRAF
SCHEMBL7585664 0.80 EGFR (0.47) EGFRBRAF
SCHEMBL7588633 0.79 EGFR (0.55) EGFRBRAFHPGD
SCHEMBL7853931 0.79 EGFR (0.43) EGFR

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 1041/4885BRAF 118/4885HPGD 173/4885

“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.