SCHEMBL14769334

SCHEMBL14769334

CCCCC(C)(C)c1ccc(C2CCCCC2)c(O)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.62
CNR2 P34972 14/20 0.55
TSHR P16473 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
ALOX15 P16050 1/20 0.50
NFKB1 P19838 1/20 0.50
MAPK1 P28482 1/20 0.50
THPO P40225 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
GMNN O75496 1/20 0.50
LMNA P02545 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
APEX1 P27695 1/20 0.50

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
SCHEMBL27780548 0.95 CNR1 (0.70) CNR1CNR2TSHRALDH1A1TP53
SCHEMBL11164159 0.86 CNR2 (0.69) CNR1CNR2TSHRALDH1A1TP53
SCHEMBL11163820 0.86 CNR2 (0.69) CNR1CNR2TSHRALDH1A1TP53
SCHEMBL11163816 0.86 CNR2 (0.69) CNR1CNR2TSHRALDH1A1TP53
SCHEMBL16404769 0.86 CNR2 (0.54) CNR1CNR2TSHRALDH1A1TP53
SCHEMBL11164163 0.86 CNR2 (0.69) CNR1CNR2TSHRALDH1A1TP53
SCHEMBL11163812 0.86 CNR2 (0.69) CNR1CNR2TSHRALDH1A1TP53
SCHEMBL11165960 0.86 CNR2 (0.70) CNR1CNR2TSHRALDH1A1TP53
SCHEMBL11165957 0.86 CNR2 (0.70) CNR1CNR2TSHRALDH1A1TP53
SCHEMBL11165961 0.86 CNR2 (0.70) CNR1CNR2TSHRALDH1A1TP53

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
EP-2698383-B1 Detection of synthetic Cannabinoids RANDOX LABORATORIES LTD (GB) 2020-11-25 EP disclosed
US-9435817-B2 Detection of synthetic cannabinoids RANDOX LABORATORIES LIMITED (GB) 2016-09-06 US disclosed
US-20130065323-A1 Detection of Synthetic Cannabinoids RANDOX LABORATORIES LIMITED (GB) 2013-03-14 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 (1 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-20130065323-A1 Detection of Synthetic Cannabinoids CNR2, CNR1, MAG CNR1 2/4885CNR2 1/4885TSHR 1787/4885

“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.