SCHEMBL1016904

SCHEMBL1016904

CN(C)CC=CC(=O)N1CCc2c(sc3ncnc(Nc4cc(Cl)cc(Cl)c4)c23)C1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.72

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
SCHEMBL1016902 1.00 EGFR (0.72) EGFR
SCHEMBL937832 0.95 EGFR (0.80) EGFR
SCHEMBL13473565 0.95 EGFR (0.68) EGFR
SCHEMBL937830 0.95 EGFR (0.80) EGFR
SCHEMBL3613231 0.95 EGFR (0.69) EGFR
SCHEMBL1020337 0.92 EGFR (0.70) EGFR
SCHEMBL1020335 0.92 EGFR (0.70) EGFR
SCHEMBL1019386 0.92 EGFR (0.71) EGFR
SCHEMBL1019387 0.92 EGFR (0.71) EGFR
SCHEMBL1015528 0.92 EGFR (0.73) 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