SCHEMBL29019200

SCHEMBL29019200

O=C(NC12CC3CC(CC(C3)C1)C2)c1nn(CCCCCCl)c2ccccc12

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 17/20 0.80
CNR1 P21554 9/20 0.80
HDAC1 Q13547 2/20 0.55
HDAC6 Q9UBN7 2/20 0.55

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
SCHEMBL13502770 0.99 CNR2 (0.81) CNR2CNR1HDAC1HDAC6
SCHEMBL17297543 0.90 CNR2 (0.80) CNR2CNR1HDAC1HDAC6
SCHEMBL31052991 0.89 CNR2 (0.81) CNR2CNR1HDAC1HDAC6
SCHEMBL29359055 0.89 CNR2 (1.00) CNR2CNR1
SCHEMBL13502771 0.89 CNR2 (0.81) CNR2CNR1HDAC1HDAC6
SCHEMBL24222016 0.89 CNR2 (0.81) CNR2CNR1HDAC1HDAC6
SCHEMBL16755272 0.89 CNR2 (1.00) CNR2CNR1
SCHEMBL17388191 0.89 CNR2 (0.81) CNR2CNR1HDAC1HDAC6
SCHEMBL17388587 0.88 CNR2 (0.79) CNR2CNR1HDAC1HDAC6
SCHEMBL13502769 0.86 CNR2 (0.77) CNR2CNR1HDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230270763-A1 METHOD OF TREATING CORONOVIRUS INFECTIONS WITH CANNABINOIDS AND DERIVATIVES PASCAL BIOSCIENCES INC (CA) 2023-08-31 US disclosed
CN-116297923-A Rapid identification method for indole and indazole type synthetic cannabinoid novel psychoactive substance structure 广西大学 2023-06-23 CN 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-20230270763-A1 METHOD OF TREATING CORONOVIRUS INFECTIONS WITH CANNABINOIDS AND DERIVATIVES CNR1, CNR2, SARS1 CNR2 2/4885CNR1 1/4885HDAC1 3712/4885

“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.