SCHEMBL7480491

SCHEMBL7480491

O=c1oc(CCC2CC2)cc(O)c1C(C1CC1)C1CC1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.33
GPR84 Q9NQS5 1/20 0.33
DAO P14920 2/20 0.33
MAP1LC3B Q9GZQ8 1/20 0.32
MAP1LC3A Q9H492 1/20 0.32
CEL P19835 1/20 0.31
LNPEP Q9UIQ6 8/20 0.31
HCAR2 Q8TDS4 1/20 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
SCHEMBL6174784 0.81 MEN1 (0.35) GPR84LNPEP
SCHEMBL6178325 0.80
SCHEMBL6175205 0.80 HTR2B (0.46) DAO
SCHEMBL6175129 0.74 ELANE (0.33) ELANECELHCAR2
SCHEMBL9197301 0.74 ELANE (0.34) ELANEGPR84CELHCAR2
SCHEMBL6173939 0.71 MAPT (0.31)
SCHEMBL6174712 0.70 HPGD (0.33)
SCHEMBL9198707 0.69 CEL (0.41) GPR84CEL
SCHEMBL6177695 0.67 CYP2C9 (0.38) ELANE
SCHEMBL6174860 0.65 ELANE (0.33) ELANE

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-0668860-B1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES UPJOHN CO (US) 2002-09-11 EP claimed