SCHEMBL29344267

SCHEMBL29344267

Cc1cc2ccc([C@H]3CC[C@H](CC4CN(C)CCC4c4nc5cc(C6=NC[C@@H](C)CC6)ccc5cc4C)CN3)cc2nc1C1CCN(C)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
SCHEMBL29081354 0.81 MAP4K1 (0.36) —
SCHEMBL30469845 0.81 MAP4K1 (0.36) —
SCHEMBL24365030 0.81 MAP4K1 (0.36) —
SCHEMBL30470215 0.75 MAP4K1 (0.34) —
SCHEMBL24365024 0.75 MAP4K1 (0.34) —
SCHEMBL29081221 0.75 MAP4K1 (0.34) —
SCHEMBL25321547 0.69 MAP4K1 (0.38) —
SCHEMBL25321555 0.69 MAP4K1 (0.38) —
SCHEMBL24364988 0.67 MAP4K1 (0.36) —
SCHEMBL30469859 0.67 MAP4K1 (0.36) —

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
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 — — US disclosed
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