SCHEMBL14640336

SCHEMBL14640336

C=CC[C@H]1C[C@@H](C)COC1=O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.35
PRSS1 P07477 2/20 0.33
CTRC Q99895 2/20 0.33
F2 P00734 1/20 0.33

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
SCHEMBL24713676 1.00 FAAH (0.35) FAAHPRSS1CTRCF2
SCHEMBL576371 0.81
SCHEMBL577431 0.74 KMT2A (0.42) FAAHPRSS1CTRCF2
SCHEMBL14883094 0.74 KMT2A (0.42) FAAHPRSS1CTRCF2
SCHEMBL16882772 0.73 PRSS1 (0.33) PRSS1CTRCF2
SCHEMBL16014176 0.72 PRSS1 (0.38) FAAHPRSS1CTRCF2
SCHEMBL7619973 0.72 FAAH (0.34) FAAH
SCHEMBL1200286 0.70 PRSS1 (0.34) FAAHPRSS1CTRCF2
SCHEMBL19336322 0.70 HTT (0.41)
SCHEMBL9667698 0.70 HTT (0.42)

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-20070015260-A1 Synthesis of synthons for the manufacture of bioactive compounds DIVERSA CORPORATION 2007-01-18 US disclosed