SCHEMBL18901927

SCHEMBL18901927

C=CC(=O)Nc1cc(Nc2nc(-c3cnn(C)c3)c3cc[nH]c3n2)c(CC)cc1N(C)CCN(C)C

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.83

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
SCHEMBL17467207 0.91 EGFR (1.00) EGFR
SCHEMBL17467077 0.81 EGFR (1.00) EGFR
SCHEMBL19239594 0.81 EGFR (0.82) EGFR
SCHEMBL17467392 0.79 EGFR (0.79) EGFR
SCHEMBL17467229 0.79 EGFR (0.79) EGFR
SCHEMBL17467210 0.79 EGFR (1.00) EGFR
SCHEMBL17467050 0.77 EGFR (1.00) EGFR
SCHEMBL17467209 0.77 EGFR (1.00) EGFR
SCHEMBL17467220 0.77 EGFR (0.76) EGFR
SCHEMBL21517139 0.77 EGFR (0.84) 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-3173412-A1 2,4-DISUBSTITUTED 7H-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE, PREPARATION METHOD AND MEDICINAL USE THEREOF Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) 2017-05-31 EP disclosed