SCHEMBL136301

SCHEMBL136301

Cc1ccc(-c2c(C(C)C(=O)O)c(C)nc3sc(C)c(C)c23)cc1

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
SCHEMBL132966 0.86 — —
SCHEMBL134657 0.86 — —
SCHEMBL134802 0.84 — —
SCHEMBL99928 0.83 — —
SCHEMBL140779 0.81 — —
SCHEMBL132681 0.80 KMT2A (0.66) —
SCHEMBL135475 0.80 — —
SCHEMBL135618 0.78 PSIP1 (0.41) —
SCHEMBL133036 0.77 — —
SCHEMBL137104 0.77 CSNK2A2 (0.47) —

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
US-8785638-B2 Thieno [2, 3-B] pyridine derivatives as viral replication inhibitors KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2014-07-22 — — US disclosed
EP-2430029-A1 THIENO [2, 3-B]PYRIDINE DERIVATIVES AS VIRAL REPLICATION INHIBITORS Katholieke Universiteit Leuven (BE) 2012-03-21 — — EP disclosed
US-20120059028-A1 THIENO [2, 3-B] PYRIDINE DERIVATIVES AS VIRAL REPLICATION INHIBITORS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2012-03-08 — — US disclosed
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