SCHEMBL4886396

SCHEMBL4886396

CC12CCC(C1)C(C)(C)C2NC(=O)c1nn(Cc2ccccc2)c2c1C[S+]([O-])CC2

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.45
CNR1 P21554 7/20 0.45
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42

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
SCHEMBL4709016 0.87 CNR2 (0.40) CNR2CNR1TAS1R3TAS1R1
SCHEMBL13871505 0.87 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL10216961 0.87 CNR2 (0.52) CNR2CNR1TAS1R3TAS1R1
SCHEMBL13871431 0.84 CNR2 (0.46) CNR2CNR1TAS1R3TAS1R1
SCHEMBL4879062 0.84 CNR2 (0.46) CNR2CNR1TAS1R3TAS1R1
SCHEMBL4881359 0.83 CNR2 (0.45) CNR2CNR1TAS1R3TAS1R1
SCHEMBL5314686 0.81 CNR2 (0.48) CNR2CNR1TAS1R3TAS1R1
SCHEMBL14003099 0.80 CNR2 (0.60) CNR2CNR1
SCHEMBL13871430 0.80 CNR2 (0.44) CNR2CNR1TAS1R3TAS1R1
SCHEMBL5317181 0.80 CNR2 (0.45) CNR2CNR1TAS1R3TAS1R1

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-20080085899-A1 TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS LIOTTA FINA 2008-04-10 US claimed
US-7524964-B2 Tetrahydrothiopyrano pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA NV (BE) 2009-04-28 US disclosed
US-7524964-B2 Tetrahydrothiopyrano pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA NV (BE) 2009-04-28 US disclosed
US-20080085899-A1 TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS LIOTTA FINA 2008-04-10 US disclosed
US-20080085899-A1 TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS LIOTTA FINA 2008-04-10 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-20080085899-A1 TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS CNR1, CNR2, GPR18 CNR2 2/4885CNR1 1/4885TAS1R3 596/4885

“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.