SCHEMBL6207882

SCHEMBL6207882

OC(CCCc1ccccc1)c1ncco1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.49
CES1 P23141 2/20 0.49
NCEH1 Q6PIU2 1/20 0.49
HPGD P15428 1/20 0.38

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
SCHEMBL13129847 0.92 FAAH (0.44) FAAHCES1NCEH1
SCHEMBL6668396 0.83 CES1 (0.40) FAAHCES1NCEH1
SCHEMBL24814189 0.83 FAAH (0.45) FAAHCES1NCEH1HPGD
SCHEMBL7042177 0.78 METAP2 (0.41) FAAHCES1NCEH1
SCHEMBL5431177 0.78 METAP2 (0.41) FAAHCES1NCEH1
SCHEMBL5954984 0.78 METAP2 (0.41) FAAHCES1NCEH1
SCHEMBL12342279 0.78 FAAH (0.49) FAAHCES1NCEH1
SCHEMBL24814124 0.77 FAAH (0.46) FAAHCES1NCEH1
SCHEMBL13129849 0.76 KMT2A (0.41) FAAHCES1NCEH1
SCHEMBL6476667 0.76 GRIN2D (0.40)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1515726-A1 MORPHOLINE AND TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS CATHEPSIN INHIBITORS Aventis Pharmaceuticals, Inc. (US) 2005-03-23 EP disclosed
WO-2004002491-A1 MORPHOLINE AND TETRAHYDROPYRAN DRIVATIVES AND THEIR USE AS CATHEPSIN INHIBITORS AVENTIS PHARMACEUTICALS INC. (US) 2004-01-08 WO disclosed