SCHEMBL27076099

SCHEMBL27076099

COc1cc(C2CCN(C(C)=O)CC2)ccc1Nc1ncc(Cl)c(Nc2ccc3nccnc3c2NS(C)(=O)=O)n1

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 10/20 0.76
▸ MET P08581 1/20 0.57
▸ ALK Q9UM73 9/20 0.56
▸ IGF1R P08069 1/20 0.53
▸ KCNH2 Q12809 1/20 0.53

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
SCHEMBL30015598 1.00 EGFR (0.76) EGFRMETALKIGF1RKCNH2
SCHEMBL27075979 0.92 EGFR (0.74) EGFRMETALKIGF1R
SCHEMBL27076030 0.88 EGFR (0.74) EGFRMETALKKCNH2
SCHEMBL21846983 0.86 EGFR (1.00) EGFRMET
SCHEMBL21846970 0.82 EGFR (1.00) EGFRMET
SCHEMBL27076117 0.82 ALK (0.65) EGFRMETALKIGF1RKCNH2
SCHEMBL27076036 0.81 EGFR (0.74) EGFRALK
SCHEMBL27076173 0.81 EGFR (0.61) EGFRMETALKIGF1RKCNH2
SCHEMBL27075996 0.80 EGFR (0.64) EGFRMETALK
SCHEMBL29173188 0.79 EGFR (0.61) EGFRMETALKIGF1RKCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4313969-A1 N2-PHENYLPYRIMIDINE-2,4-DIAMINE COMPOUNDS, AND PREPARATION METHODS AND METHODS OF USE THEREOF Bridge Biotherapeutics, Inc. (KR) 2024-02-07 — — EP disclosed
CN-117203199-A N2-phenylpyrimidine-2, 4-diamine compounds, methods of making and using the same 毕利吉生物科技股份有限公司 2023-12-08 — — CN disclosed
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