SCHEMBL6345433

SCHEMBL6345433

CCCCCCc1ccc(O)c(C2CCCCC2)c1O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.55
CNR1 P21554 10/20 0.48
CNR2 P34972 9/20 0.48
ALOX5 P09917 2/20 0.45
MEN1 O00255 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
RBP1 P09455 1/20 0.42
ELANE P08246 1/20 0.40
CTSG P08311 1/20 0.40
PTGS2 P35354 1/20 0.39

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
SCHEMBL27957139 0.88 CNR1 (0.47) TYRCNR1CNR2ALOX5MEN1
SCHEMBL28270547 0.83 BID (0.50) CNR1CNR2ALOX5MAPTALOX15
SCHEMBL28187955 0.81 BID (0.48) CNR1CNR2ALOX5MAPTALOX15
SCHEMBL32679952 0.79 CNR1 (0.43) TYRCNR1CNR2ALOX5MEN1
SCHEMBL30215704 0.79 CNR1 (0.43) TYRCNR1CNR2ALOX5MEN1
SCHEMBL32679953 0.79 CNR1 (0.43) TYRCNR1CNR2ALOX5MEN1
SCHEMBL28389443 0.78 NUDT1 (0.38) CNR1CNR2
SCHEMBL11022771 0.77 ALOX5 (0.49) TYRCNR1CNR2ALOX5RBP1
SCHEMBL7737889 0.77 ACMSD (0.46) TYRCNR1CNR2ALOX5MEN1
SCHEMBL28674717 0.77 ELANE (0.44) TYRCNR1CNR2ALOX5MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7285687-B2 Cannabinoids VIRGINIA COMMONWEALTH UNIVERSITY (US) 2007-10-23 US disclosed
US-20050165259-A1 Such as 2-(3-methylcyclohexyl)-5-(1,1'-dimethylheptyl)-resorcinol for treatment of pain, inflammation and autoimmune disease VIRGINIA COMMONWEALTH UNIVERSITY (US) 2005-07-28 US disclosed
US-20050159449-A1 Cannabinoids VIRGINIA COMMONWEALTH UNIVERSITY (US) 2005-07-21 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 (2 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-20050165259-A1 Such as 2-(3-methylcyclohexyl)-5-(1,1'-dimethylheptyl)-resorcinol for treatment of pain, inflammation and autoimmune disease CNR1, CNR2, HRH4 TYR 950/4885CNR1 1/4885CNR2 2/4885
US-20050159449-A1 Cannabinoids CNR1, CNR2, OPRL1 TYR 1117/4885CNR1 1/4885CNR2 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.