SCHEMBL10653170

SCHEMBL10653170

CCCCCCC(C)(C)c1cc(O)cc(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 19/20 0.61
CNR2 P34972 19/20 0.61
PTGS2 P35354 1/20 0.54

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
SCHEMBL5425933 0.90 CNR2 (0.57) CNR1CNR2
SCHEMBL69123 0.87 CNR1 (0.58) CNR1CNR2PTGS2
SCHEMBL31545799 0.87 CNR1 (0.58) CNR1CNR2PTGS2
SCHEMBL2027212 0.87 CNR1 (0.58) CNR1CNR2PTGS2
SCHEMBL23601974 0.86 CNR2 (0.55) CNR1CNR2
SCHEMBL5916439 0.85 CNR1 (0.56) CNR1CNR2PTGS2
SCHEMBL10653359 0.84 CNR1 (0.64) CNR1CNR2
SCHEMBL23802246 0.83 CNR2 (0.50) CNR1CNR2PTGS2
SCHEMBL10914094 0.83 CNR2 (0.53) CNR1CNR2
SCHEMBL10724501 0.83 CNR2 (0.58) CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0096480-B1 PREPARATION OF 6A, 10A-TRANS-HEXAHYDRODIBENZOPYRANONES ELI LILLY AND COMPANY (US) 1988-09-28 EP claimed
EP-0096480-A2 Preparation of 6a, 10a-trans-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1983-12-21 EP claimed
EP-0096480-B1 PREPARATION OF 6A, 10A-TRANS-HEXAHYDRODIBENZOPYRANONES ELI LILLY AND COMPANY (US) 1988-09-28 EP disclosed
EP-0096480-A2 Preparation of 6a, 10a-trans-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1983-12-21 EP disclosed
US-4395560-A Preparation of 6a,10a-trans-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1983-07-26 US disclosed