SCHEMBL28382492

SCHEMBL28382492

C=CC(=O)Nc1cccc(-c2cccc3cnc(Nc4ccc([C@@H]5OCCNC5CN)cc4OC)nc23)c1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 14/20 0.51
▸ FGFR1 P11362 3/20 0.51
▸ KDR P35968 3/20 0.51
▸ FGFR2 P21802 3/20 0.48
▸ JAK3 P52333 2/20 0.48

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
SCHEMBL28388817 1.00 EGFR (0.51) EGFRFGFR1KDRFGFR2JAK3
SCHEMBL28382494 1.00 EGFR (0.51) EGFRFGFR1KDRFGFR2JAK3
SCHEMBL28388424 0.91 JAK3 (0.46) EGFRJAK3
SCHEMBL28384241 0.91 JAK3 (0.46) EGFRJAK3
SCHEMBL28384240 0.91 JAK3 (0.46) EGFRJAK3
SCHEMBL28382418 0.89 EGFR (0.60) EGFRFGFR1KDRFGFR2JAK3
SCHEMBL28394153 0.89 EGFR (0.60) EGFRFGFR1KDRFGFR2JAK3
SCHEMBL28382417 0.89 EGFR (0.60) EGFRFGFR1KDRFGFR2JAK3
SCHEMBL28387790 0.89 EGFR (0.51) EGFRFGFR1KDRFGFR2JAK3
SCHEMBL28387794 0.89 EGFR (0.51) EGFRFGFR1KDRFGFR2JAK3

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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