SCHEMBL28388093

SCHEMBL28388093

C=CC(=O)Nc1cccc(-c2c(CC)ccc3cnc(Nc4ccc(C5CNCCO5)cc4)nc23)c1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.48
▸ FGFR2 P21802 1/20 0.45
▸ PTK2 Q05397 1/20 0.44

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
SCHEMBL28388722 0.92 EGFR (0.45) EGFRFGFR2
SCHEMBL28394043 0.91 EGFR (0.47) EGFRFGFR2
SCHEMBL28385553 0.90 BTK (0.49) EGFR
SCHEMBL28383433 0.90 EGFR (0.47) EGFR
SCHEMBL28388017 0.89 — —
SCHEMBL28388723 0.88 FGFR1 (0.41) EGFRFGFR2
SCHEMBL28385550 0.87 EGFR (0.61) EGFRFGFR2
SCHEMBL28387956 0.83 EGFR (0.45) EGFRFGFR2
SCHEMBL28385855 0.82 EGFR (0.53) EGFRFGFR2
SCHEMBL16515534 0.81 BTK (0.66) EGFRFGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105682661-B Certain chemical entities, compositions, and methods 润新生物公司 2020-03-27 — — CN claimed
CN-109851617-B Chemical entities, compositions, and methods 润新生物公司 2022-08-16 — — CN disclosed
CN-111285813-A Chemical entities, compositions, and methods 润新生物公司 2020-06-16 — — CN disclosed
CN-105682661-B Certain chemical entities, compositions, and methods 润新生物公司 2020-03-27 — — CN disclosed
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