SCHEMBL27803986

SCHEMBL27803986

Fc1cc(-n2ccc3cnc(Nc4ccncn4)nc32)cc(F)c1C1CNCCO1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA3 P51812 1/20 0.40
▸ JAK2 O60674 2/20 0.38
▸ BRD4 O60885 2/20 0.38

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
SCHEMBL27824888 0.89 RPS6KA3 (0.45) RPS6KA3JAK2BRD4
SCHEMBL27824865 0.86 RPS6KA3 (0.44) RPS6KA3JAK2BRD4
SCHEMBL28786504 0.83 RPS6KA3 (0.40) RPS6KA3JAK2BRD4
SCHEMBL28790440 0.78 STAT6 (0.49) RPS6KA3JAK2BRD4
SCHEMBL27803985 0.77 RPS6KA3 (0.56) RPS6KA3JAK2BRD4
SCHEMBL27804078 0.77 JAK2 (0.43) RPS6KA3JAK2BRD4
SCHEMBL28790311 0.75 JAK2 (0.44) JAK2BRD4
SCHEMBL1655623 0.74 RPS6KA3 (0.50) RPS6KA3JAK2BRD4
SCHEMBL27803977 0.73 JAK2 (0.47) JAK2BRD4
SCHEMBL27804170 0.72 JAK2 (0.46) JAK2BRD4

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
CN-101981036-A Pyrrolo [2, 3-D] pyridines and use thereof as tyrosine kinase inhibitors NOVARTIS AG 2011-02-23 — — CN claimed
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