SCHEMBL23735109

SCHEMBL23735109

C=CC(=O)N1CCCC(Nc2ncnc(N)c2C(=N)c2ccc(OCc3cccc(F)c3)c(C#N)c2)C1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 5/20 0.52
JAK3 P52333 11/20 0.47
EGFR P00533 5/20 0.45
JAK1 P23458 1/20 0.42

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
SCHEMBL23735001 0.92 BTK (0.55) BTKJAK3EGFRJAK1
SCHEMBL19097623 0.90 BTK (0.54) BTKJAK3EGFRJAK1
SCHEMBL19097594 0.90 BTK (0.54) BTKJAK3EGFRJAK1
SCHEMBL19097937 0.90 BTK (0.56) BTKJAK3EGFRJAK1
SCHEMBL19098098 0.87 BTK (0.55) BTKJAK3EGFRJAK1
SCHEMBL23734998 0.86 EGFR (0.56) BTKJAK3EGFR
SCHEMBL23735117 0.86 BTK (0.55) BTKJAK3EGFRJAK1
SCHEMBL19098031 0.85 BTK (0.61) BTKJAK3EGFRJAK1
SCHEMBL23735009 0.84 BTK (0.51) BTKJAK3EGFRJAK1
SCHEMBL19098101 0.83 BTK (0.56) BTKJAK3EGFRJAK1

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-3398950-B1 NOVEL KINASE INHIBITOR AGAINST WILD-TYPE EGFR AND MUTATED EGFR PRECEDO PHARMACEUTICALS CO LTD (CN) 2021-08-11 EP disclosed