SCHEMBL8779995

SCHEMBL8779995

CCC1C(=O)C2CCC1C2

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL24587183 1.00 ALDH1A1 (0.36) ALDH1A1
SCHEMBL14721191 1.00 ALDH1A1 (0.36) ALDH1A1
SCHEMBL6712345 0.79 ALDH1A1 (0.34) ALDH1A1
SCHEMBL11773282 0.78 ALDH1A1 (0.36) ALDH1A1
SCHEMBL24586815 0.77 ALDH1A1 (0.35) ALDH1A1
SCHEMBL11769174 0.75 ALDH1A1 (0.34) ALDH1A1
SCHEMBL26934700 0.75 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1928623 0.74
SCHEMBL8740473 0.74 HSD11B1 (0.35) ALDH1A1
SCHEMBL24586795 0.74 PRSS1 (0.38) ALDH1A1

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
WO-2013026852-A2 DERIVATIVES OF MECAMYLAMINE THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, AND THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2013-02-28 WO disclosed
EP-0528694-B1 Method for producing optically active 3-substituted-2-norbornanones and their intermediates CHISSO CORP (JP) 1997-04-09 EP disclosed
US-5266728-A Method for producing optically active 3-substituted-2-norbornanones and their intermediates CHISSO CORPORATION (JP) 1993-11-30 US disclosed
EP-0528694-A2 Method for producing optically active 3-substituted-2-norbornanones and their intermediates CHISSO CORPORATION (JP) 1993-02-24 EP disclosed