SCHEMBL31069713

SCHEMBL31069713

CC1CC(=O)OC12CO2

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
SCHEMBL6059815 0.71
SCHEMBL16904971 0.71
SCHEMBL13327624 0.71
SCHEMBL19958880 0.68 SMN1; SMN2 (0.37)
SCHEMBL7992810 0.67 LMNA (0.40)
SCHEMBL12203799 0.65 MAPK1 (0.49)
SCHEMBL24780441 0.64 SMN1; SMN2 (0.33)
SCHEMBL30856748 0.64 SMN1; SMN2 (0.33)
SCHEMBL5763756 0.64 LMNA (0.38)
SCHEMBL12183868 0.64 SMN1; SMN2 (0.33)

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-12064239-B2 Device and methods for detection and monitoring of tuberculosis TECHNION RESEARCH & DEVELOPMENT FOUNDATION LIMITED (IL) 2024-08-20 US disclosed