SCHEMBL4567351

SCHEMBL4567351

COc1cc(CO)cc(C(C)(C)CCCC(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.39
CNR1 P21554 14/20 0.38
TRPV1 Q8NER1 1/20 0.35
PTGS2 P35354 1/20 0.34
DAO P14920 1/20 0.34
CALM1 P0DP23 1/20 0.32

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
SCHEMBL3705499 0.88 CNR2 (0.44) CNR2CNR1TRPV1
SCHEMBL3693693 0.84 CNR2 (0.45) CNR2CNR1PTGS2
SCHEMBL3434656 0.79 PTGS2 (0.39) CNR2CNR1PTGS2DAOCALM1
SCHEMBL17414524 0.77 CNR2 (0.47) CNR2CNR1TRPV1
SCHEMBL20285804 0.76 CA1 (0.42) PTGS2DAOCALM1
SCHEMBL6716285 0.73 CNR2 (0.43) CNR2CNR1PTGS2
SCHEMBL3701630 0.73 PKM (0.47) CNR2CNR1
SCHEMBL13819538 0.72 ALOX5 (0.41) CNR2CNR1PTGS2
SCHEMBL3948413 0.72 RXRA (0.49) DAO
SCHEMBL17124420 0.70 DAO (0.40) PTGS2DAOCALM1

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
US-9173867-B2 Treatment of immune dysregulation using cannabinoid derivatives IMMUGEN PHARMACEUTICALS, INC. (US) 2015-11-03 US disclosed
US-20140066497-A1 TREATMENT OF IMMUNE DYSREGULATION USING CANNABINOID DERIVATIVES IMMUGEN PHARMACEUTICALS, INC. 2014-03-06 US disclosed
US-8586767-B2 Method for treatment of HIV and diseases of immune dysregulation TRAVIS CRAIG RICK (US) 2013-11-19 US disclosed
US-20120289589-A1 Treatment Of Immune Dysregulation Using Cannabinoid Derivatives TRAVIS CRAIG RICK (US) 2012-11-15 US disclosed
US-20120122917-A1 Method For Treatment Of HIV And Diseases Of Immune Dysregulation TRAVIS CRAIG RICK (US) 2012-05-17 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-20140066497-A1 TREATMENT OF IMMUNE DYSREGULATION USING CANNABINOID DERIVATIVES CNR2, CNR1, GPR18 CNR2 1/4885CNR1 2/4885TRPV1 39/4885
US-20120289589-A1 Treatment Of Immune Dysregulation Using Cannabinoid Derivatives CNR2, CNR1, GPR18 CNR2 1/4885CNR1 2/4885TRPV1 39/4885
US-20120122917-A1 Method For Treatment Of HIV And Diseases Of Immune Dysregulation CNR2, CNR1, ICOS CNR2 1/4885CNR1 2/4885TRPV1 450/4885

“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.