SCHEMBL31292848

SCHEMBL31292848

Nc1cccc(C2(N)CCC2)c1

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
SCHEMBL14737935 0.78
SCHEMBL7349461 0.78 SLC6A4 (0.54)
SCHEMBL21377671 0.78 CYP3A4 (0.42)
SCHEMBL31292756 0.78
SCHEMBL8952423 0.78 KDM1A (0.52)
SCHEMBL15021523 0.78 OPRD1 (0.46)
SCHEMBL18769426 0.78
SCHEMBL23198937 0.77 ALDH1A1 (0.54)
Hydrochloric Acid SCHEMBL14738090 0.76
Hydrochloric Acid SCHEMBL4493227 0.76 SLC6A4 (0.53)

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
WO-2025024030-A2 MOLECULAR GLUES TARGETING A TRANSCRIPTIONAL REGULATOR OF ABERRANT METABOLIC STATES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-01-30 WO disclosed