SCHEMBL4650449

SCHEMBL4650449

Nc1cc(O)nc(Br)n1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4254844 0.81 — —
SCHEMBL94409 0.74 — —
SCHEMBL29585390 0.74 — —
SCHEMBL7697864 0.74 — —
SCHEMBL94169 0.74 — —
Water SCHEMBL8928299 0.72 HRH4 (0.35) —
SCHEMBL30355316 0.72 NOS3 (0.32) —
Hydrochloric Acid SCHEMBL30378836 0.72 HRH4 (0.35) —
Hydrochloric Acid SCHEMBL28660339 0.72 HRH4 (0.35) —
SCHEMBL94606 0.70 — —

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-101331133-A Sulphonamidoaniline derivatives as Janus kinase inhibitors NOVARTIS AG (CH) 2008-12-24 — — CN disclosed
US-20080261973-A1 Sulphonamidoaniline Derivatives Being Janus Kinase Inhibitors NOVARTIS AG (CH) 2008-10-23 — — US disclosed
EP-1966210-A2 SULPHONAMIDOANILINE DERIVATIVES BEING JANUS KINASES INHIBITORS Novartis AG (CH) 2008-09-10 — — EP disclosed
WO-2007071393-A2 SULPHONAMIDOANILINE DERIVATIVES BEING JANUS KINASES INHIBITORS NOVARTIS AG (CH) 2007-06-28 — — WO disclosed
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