SCHEMBL13770795

SCHEMBL13770795

CC1=CC2C([C@@H](C)C(=O)O)CC[C@@H](C)[C@@H]2CC1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.40
TAS2R46 P59540 2/20 0.30

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
SCHEMBL12821007 1.00 CES2 (0.40) CES2TAS2R46
SCHEMBL13771160 1.00 CES2 (0.40) CES2TAS2R46
SCHEMBL12305441 1.00 CES2 (0.40) CES2TAS2R46
SCHEMBL1446617 1.00 CES2 (0.40) CES2TAS2R46
SCHEMBL10042111 1.00 CES2 (0.40) CES2TAS2R46
SCHEMBL18780386 1.00 CES2 (0.40) CES2TAS2R46
Hydrogen Peroxide SCHEMBL5076367 1.00 CES2 (0.40) CES2TAS2R46
SCHEMBL13771155 1.00 CES2 (0.40) CES2TAS2R46
SCHEMBL14747987 1.00 CES2 (0.40) CES2TAS2R46
SCHEMBL18950962 1.00 CES2 (0.40) CES2TAS2R46

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-2009088404-A1 PROCESSES FOR THE PREPARATION OF ARTEMISININ AN ITS PRECURSORS AMYRIS BIOTECHNOLOGIES, INC. (US) 2009-07-16 WO disclosed