SCHEMBL14220652

SCHEMBL14220652

CCC1=CC(C)=C(OC)CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34

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
SCHEMBL13068837 0.79 NOS3 (0.34) NOS3NOS2
SCHEMBL12662661 0.73
SCHEMBL14730595 0.71 AOC3 (0.32)
SCHEMBL17864795 0.65 LMNA (0.33)
SCHEMBL13652335 0.64
SCHEMBL19441263 0.62 NOS3 (0.38) NOS3NOS2
SCHEMBL14529162 0.61 NOS3 (0.36) NOS3NOS2
SCHEMBL7050607 0.61
SCHEMBL6285473 0.61
SCHEMBL9028897 0.60 NOS3 (0.37) NOS3NOS2

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
EP-1592700-B1 AVERMECTIN- AND AVERMECTIN MONOSACCHARIDE DERIVATIVES SUBSTITUTED IN THE 4''- OR 4'- POSITION HAVING PESTICIDAL PROPERTIES MERIAL LTD (GB) 2008-04-02 EP disclosed