SCHEMBL31387261

SCHEMBL31387261

Nc1nc(C2CC2)n[nH]1

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
SCHEMBL14833240 0.86 GAA (0.44) —
SCHEMBL19127856 0.82 HTR1D (0.39) —
SCHEMBL18037592 0.78 GAA (0.39) —
SCHEMBL25036642 0.76 CHIT1 (0.33) —
SCHEMBL21802311 0.73 PDE10A (0.38) —
SCHEMBL15200530 0.71 — —
SCHEMBL21884127 0.71 — —
SCHEMBL18037528 0.70 L3MBTL1 (0.39) —
SCHEMBL31727234 0.70 ALDH1A1 (0.35) —
SCHEMBL31754738 0.70 ALDH1A1 (0.35) —

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
US-20260001886-A1 ENPP1 INHIBITORS I RE VENTURES I LLC (US) 2026-01-01 — — US disclosed
WO-2025233863-A1 ENPP1 INHIBITORS RE VENTURES I, LLC (US) 2025-11-13 — — WO disclosed
US-20250333419-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF WRN INCYTE CORPORATION (US) 2025-10-30 — — US disclosed
WO-2024255765-A1 NOVEL COMPOUNDS, COMPOSITIONS COMPRISING THE SAME AND USES THEREOF NUPHASE THERAPEUTICS (HANGZHOU) LIMITED., CO. (CN) 2024-12-19 — — WO disclosed
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