SCHEMBL4567343

SCHEMBL4567343

Cc1c(O)cc(C(C)(C)C#CCCC(C)C)cc1O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.31
AKT1 P31749 2/20 0.31
PDPK1 O15530 1/20 0.31
PHLPP1 O60346 1/20 0.31
ILK Q13418 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
SCHEMBL6419752 0.73 LMNA (0.31)
SCHEMBL6838141 0.70 CNR1 (0.44) ACHEAKT1PDPK1PHLPP1ILK
SCHEMBL31546039 0.66 ACHE (0.34) ACHE
SCHEMBL22096994 0.65 ALDH1A1 (0.44)
SCHEMBL9744092 0.62 GABRA1 (0.55) ACHE
SCHEMBL29287611 0.60 ACHE (0.35) ACHEAKT1PDPK1PHLPP1ILK
SCHEMBL10710668 0.59 LMNA (0.35)
SCHEMBL23660488 0.58 OPRM1 (0.32)
SCHEMBL29287610 0.58 NR1H2 (0.38) ACHEAKT1
SCHEMBL26418264 0.58 ACHE (0.41) ACHEAKT1PDPK1PHLPP1ILK

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 13 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-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-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-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
US-20120122917-A1 Method For Treatment Of HIV And Diseases Of Immune Dysregulation TRAVIS CRAIG RICK (US) 2012-05-17 US disclosed
US-20080108647-A1 Treatment of HIV and diseases of immune dysregulation TRAVIS CRAIG R 2008-05-08 US disclosed
US-20080108647-A1 Treatment of HIV and diseases of immune dysregulation TRAVIS CRAIG R 2008-05-08 US disclosed
US-20070179135-A1 Cannabinoid derivatives TRAVIS CRAIG R 2007-08-02 US disclosed
US-20070179135-A1 Cannabinoid derivatives TRAVIS CRAIG R 2007-08-02 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 (5 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 ACHE 2132/4885AKT1 2561/4885PDPK1 900/4885
US-20120289589-A1 Treatment Of Immune Dysregulation Using Cannabinoid Derivatives CNR2, CNR1, GPR18 ACHE 2132/4885AKT1 2561/4885PDPK1 900/4885
US-20120122917-A1 Method For Treatment Of HIV And Diseases Of Immune Dysregulation CNR2, CNR1, ICOS ACHE 938/4885AKT1 3481/4885PDPK1 1053/4885
US-20070179135-A1 Cannabinoid derivatives CNR2, CNR1, GPR18 ACHE 612/4885AKT1 2397/4885PDPK1 1062/4885
US-20080108647-A1 Treatment of HIV and diseases of immune dysregulation CNR1, CNR2, ICOS ACHE 1939/4885AKT1 2811/4885PDPK1 677/4885

“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.