SCHEMBL5430441

SCHEMBL5430441

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

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 18/20 0.63
CNR1 P21554 10/20 0.58

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
SCHEMBL20929943 0.98 CNR2 (0.61) CNR2CNR1
SCHEMBL1172463 0.84 CNR2 (0.63) CNR2CNR1
SCHEMBL1172180 0.83 CNR2 (0.59) CNR2CNR1
SCHEMBL3701630 0.81 PKM (0.47) CNR2CNR1
SCHEMBL11645221 0.80 CNR2 (0.51) CNR2CNR1
SCHEMBL11641149 0.80 CNR2 (0.60) CNR2CNR1
SCHEMBL10653170 0.79 CNR1 (0.61) CNR2CNR1
SCHEMBL1836711 0.78 CNR2 (0.55) CNR2CNR1
SCHEMBL1839235 0.78 CNR2 (0.55) CNR2CNR1
SCHEMBL1836097 0.78 CNR2 (0.55) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4087410-A 5-(Tertiary alkyl) resorcinol preparation and intermediates therefor ELI LILLY AND COMPANY (US) 1978-05-02 US claimed
US-20210198223-A1 METHODS AND COMPOSITIONS RELATING TO ULTRAPURE 5-(1,1-DIMETHYLHEPTYL)-RESORCINOL CORBUS PHARMACEUTICALS, INC. 2021-07-01 US disclosed
WO-2019079677-A1 METHODS AND COMPOSITIONS RELATING TO ULTRAPURE 5-(1,1-DIMETHYLHEPTYL)-RESORCINOL CORBUS PHARMACEUTICALS, INC. (US) 2019-04-25 WO disclosed
US-20070060636-A1 High enantiomeric purity dexanabinol for pharmaceutical compositions PHARMOS CORPORATION 2007-03-15 US disclosed
US-20070060636-A1 High enantiomeric purity dexanabinol for pharmaceutical compositions PHARMOS CORPORATION 2007-03-15 US disclosed
US-20070060636-A1 High enantiomeric purity dexanabinol for pharmaceutical compositions PHARMOS CORPORATION 2007-03-15 US disclosed
US-20040110827-A1 High enantiomeric purity dexanabinol for pharmaceutical compositions PHARMOS CORPORATION 2004-06-10 US disclosed
US-4131656-A Intermediates for 5-(tertiary alkyl) resorcinol preparation ELI LILLY AND COMPANY (US) 1978-12-26 US disclosed
US-4087410-A 5-(Tertiary alkyl) resorcinol preparation and intermediates therefor ELI LILLY AND COMPANY (US) 1978-05-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210198223-A1 METHODS AND COMPOSITIONS RELATING TO ULTRAPURE 5-(1,1-DIMETHYLHEPTYL)-RESORCINOL CNR1, DHCR24, CNR2 CNR2 3/4885CNR1 1/4885
US-20070060636-A1 High enantiomeric purity dexanabinol for pharmaceutical compositions CNR2, CNR1, PDE8B CNR2 1/4885CNR1 2/4885
US-20040110827-A1 High enantiomeric purity dexanabinol for pharmaceutical compositions CNR2, CNR1, PDE8B CNR2 1/4885CNR1 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.