SCHEMBL2288254

SCHEMBL2288254

C=CCC1CC(=O)CN1

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
SCHEMBL3292484 0.80 L3MBTL1 (0.35)
SCHEMBL17930928 0.71
SCHEMBL12326733 0.71
SCHEMBL10464804 0.71
SCHEMBL9406800 0.71
SCHEMBL172654 0.69 PNMT (0.61)
SCHEMBL14452925 0.68 BRD4 (0.33)
SCHEMBL6839636 0.66
SCHEMBL716292 0.65 ALDH1A1 (0.38)
SCHEMBL11817088 0.64 L3MBTL1 (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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2152713-B1 PYRAZOLOPYRROLIDINES AS INHIBITORS OF GAMMA SECRETASE ELAN PHARM INC (US) 2011-09-07 EP disclosed
US-7977368-B2 Pyrazolopyrrolidines as inhibitors of gamma secretase ELAN PHARMACEUTICALS, INC. (US) 2011-07-12 US disclosed
EP-2152713-A1 PYRAZOLOPYRROLIDINES AS INHIBITORS OF GAMMA SECRETASE Elan Pharmaceuticals Inc. (US) 2010-02-17 EP disclosed
US-20090099235-A1 Pyrazolopyrrolidines as Inhibitors of Gamma Secretase ELAN PHARMACEUTICALS, INC. 2009-04-16 US disclosed
WO-2008147800-A1 PYRAZOLOPYRROLIDINES AS INHIBITORS OF GAMMA SECRETASE ELAN PHARMACEUTICALS, INC. (US) 2008-12-04 WO disclosed