SCHEMBL20180328

SCHEMBL20180328

CC1(C)OB(c2cccc(-c3ccc4ccc(Nc5cccc(-c6cccc(-c7cccc(C8=NC(c9ccccc9)=NC(c9ccccc9)N8)c7)c6)c5)c(C=N)c4c3)c2)OC1(C)C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.30

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
SCHEMBL20180154 0.82 LIPG (0.41) EGFR
SCHEMBL20038797 0.82 LIPG (0.39)
SCHEMBL19774525 0.78 LIPG (0.40)
SCHEMBL22486473 0.73 LIPG (0.51)
SCHEMBL20180182 0.73 EGFR (0.40) EGFR
SCHEMBL21781485 0.73 LIPG (0.52)
SCHEMBL20407029 0.73 LIPG (0.52)
SCHEMBL16189113 0.71 LPL (0.34)
SCHEMBL20180228 0.71 LIPG (0.38) EGFR
SCHEMBL20180231 0.69 LIPG (0.45) 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
WO-2018093107-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2018-05-24 WO disclosed