SCHEMBL7036607

SCHEMBL7036607

C=C(I)N1CCC(CC)C1=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PER2 O15055 1/20 0.33
CRY2 Q49AN0 1/20 0.33
FAAH O00519 1/20 0.32
ACE P12821 2/20 0.31

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
SCHEMBL3226035 0.78 ACE (0.39) PER2CRY2FAAHACE
SCHEMBL532775 0.76 FAAH (0.40) PER2CRY2FAAHACE
SCHEMBL27386914 0.71
SCHEMBL1524639 0.71
SCHEMBL12341085 0.70 PDE4A (0.42)
SCHEMBL3733255 0.70 PDE4A (0.42)
SCHEMBL3143437 0.69
SCHEMBL14905891 0.69
SCHEMBL28677943 0.68 PER2 (0.40) PER2CRY2ACE
SCHEMBL2602295 0.68 DPP4 (0.36) PER2CRY2ACE

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-20030001239-A1 Porous materials SHIPLEY COMPANY, L.L.C. (US) 2003-01-02 US disclosed