SCHEMBL1015870

SCHEMBL1015870

CCN(CC)CC=CC(=O)N1CCc2c(sc3ncnc(Nc4ccc5c(ccn5Cc5ccccn5)c4)c23)C1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 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
SCHEMBL1015867 1.00 EGFR (0.57) EGFR
SCHEMBL1017175 0.94 EGFR (0.55) EGFR
SCHEMBL1017174 0.94 EGFR (0.55) EGFR
SCHEMBL1068057 0.94 EGFR (0.62) EGFR
SCHEMBL1068058 0.94 EGFR (0.62) EGFR
SCHEMBL3620439 0.92 EGFR (0.61) EGFR
SCHEMBL1015611 0.92 EGFR (0.61) EGFR
SCHEMBL1017151 0.92 EGFR (0.61) EGFR
SCHEMBL1017153 0.92 EGFR (0.61) EGFR
SCHEMBL1015612 0.92 EGFR (0.61) 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
EP-2001890-B1 TETRAHYDROPYRIDOTHIENOPYRIMIDINE COMPOUNDS AND USE FOR THE TREATMENT OF CELL PROLIFERATIVE DISORDERS BAYER SCHERING PHARMA AG (DE) 2011-01-12 EP disclosed