SCHEMBL23584789

SCHEMBL23584789

CSc1ncnn2c([C@H]3CC[C@@H](CN4CCC(F)(F)C[C@H]4CN(C)C)O3)ccc12

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
SCHEMBL23584487 0.89 — —
SCHEMBL23584590 0.88 DOT1L (0.32) —
SCHEMBL23584623 0.84 — —
SCHEMBL23584790 0.84 — —
SCHEMBL23584607 0.81 — —
SCHEMBL19344075 0.81 — —
SCHEMBL23584697 0.81 — —
SCHEMBL23584740 0.80 SIRT2 (0.30) —
SCHEMBL23584727 0.80 — —
SCHEMBL19344086 0.79 — —

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
EP-3426664-B1 SUBSTITUTED NUCLEOSIDE ANALOGUES FOR USE AS PRMT5 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-06-30 — — EP disclosed
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