SCHEMBL14607804

SCHEMBL14607804

COc1cc2c(cc1C(C)O)C(C)(C)C/C2=C(/C#N)C(=O)C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.31

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
SCHEMBL5397192 0.88 ALDH1A1 (0.36) EGFR
SCHEMBL5397197 0.88 ALDH1A1 (0.36) EGFR
SCHEMBL5412149 0.83 EGFR (0.40) EGFR
SCHEMBL5412146 0.83 EGFR (0.40) EGFR
SCHEMBL5403690 0.83 EGFR (0.31) EGFR
SCHEMBL5403688 0.83 EGFR (0.31) EGFR
SCHEMBL5394950 0.82 TNFSF11 (0.42) EGFR
SCHEMBL5400111 0.80 ALDH1A1 (0.31) EGFR
SCHEMBL5400109 0.80 ALDH1A1 (0.31) EGFR
SCHEMBL14542890 0.78 PDE4A (0.32)

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-1116767-B1 Electrochromic device BAYER INNOVATION GMBH (DE) 2007-02-14 EP disclosed