SCHEMBL25228504

SCHEMBL25228504

O=C(O)N1CCC[C@@H](c2nc(Br)c3c(Cl)nccn23)C1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TNK2 Q07912 16/20 0.39
▸ BTK Q06187 2/20 0.36
▸ PROKR1 Q8TCW9 1/20 0.35
▸ FGFR2 P21802 1/20 0.35

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
SCHEMBL14630141 1.00 TNK2 (0.39) TNK2BTKPROKR1FGFR2
SCHEMBL27188443 0.94 FGFR4 (0.39) TNK2BTKFGFR2
SCHEMBL27188440 0.94 FGFR4 (0.39) TNK2BTKFGFR2
SCHEMBL18283348 0.87 TNK2 (0.48) TNK2BTKFGFR2
SCHEMBL28859036 0.87 TNK2 (0.40) TNK2BTKPROKR1FGFR2
SCHEMBL14631159 0.87 TNK2 (0.48) TNK2BTKFGFR2
SCHEMBL18345372 0.85 TNK2 (0.51) TNK2BTK
SCHEMBL16748868 0.85 TNK2 (0.51) TNK2BTK
SCHEMBL14630474 0.83 TNK2 (0.47) TNK2FGFR2
SCHEMBL400077 0.83 TNK2 (0.46) TNK2FGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023110970-A1 MACROCYCLIC BTK INHIBITORS NETHERLANDS TRANSLATIONAL RESEARCH CENTER HOLDING B.V (NL) 2023-06-22 — — WO disclosed
WO-2023110936-A1 REVERSIBLE MACROCYCLIC KINASE INHIBITORS NETHERLANDS TRANSLATIONAL RESEARCH CENTER HOLDING B.V (NL) 2023-06-22 — — WO disclosed
CN-109851620-B Fused bicyclic compounds for inhibiting tyrosine kinase activity 深圳市塔吉瑞生物医药有限公司 2020-08-07 — — CN disclosed
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