SCHEMBL24687445

SCHEMBL24687445

C=CC(=O)Nc1cccc(N2C(=O)N(Cc3ccccc3)CCc3cnc(Nc4ccc(F)nc4)nc32)c1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 17/20 0.60
▸ JAK3 P52333 3/20 0.49

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
SCHEMBL24688026 0.94 EGFR (0.64) EGFRJAK3
SCHEMBL24687690 0.91 EGFR (0.62) EGFRJAK3
SCHEMBL24688036 0.90 EGFR (0.60) EGFRJAK3
SCHEMBL24688025 0.89 EGFR (0.66) EGFRJAK3
SCHEMBL24687699 0.88 EGFR (0.57) EGFRJAK3
SCHEMBL24687685 0.86 EGFR (0.63) EGFR
SCHEMBL24687812 0.86 EGFR (0.74) EGFR
SCHEMBL24687462 0.85 EGFR (0.57) EGFRJAK3
SCHEMBL24687827 0.85 EGFR (0.65) EGFRJAK3
SCHEMBL24687689 0.84 EGFR (0.58) 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-2022212538-A1 DIAZEPANONE-FUSED PYRIMIDINE COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF BLUEPRINT MEDICINES CORPORATION (US) 2022-10-06 — — WO disclosed
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