SCHEMBL4884720

SCHEMBL4884720

O=C(O)Cc1c(C(=O)NCCSCc2ccccc2)nn(-c2ccccc2F)c1-c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 18/20 0.52
ALDH1A1 P00352 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL4888939 0.85 CNR1 (0.52) CNR1
SCHEMBL4879587 0.82 CNR1 (0.71) CNR1
SCHEMBL4890922 0.80 CNR1 (0.62) CNR1
SCHEMBL4880580 0.79 CNR1 (0.72) CNR1
SCHEMBL4882132 0.78 CNR1 (0.65) CNR1
SCHEMBL4885548 0.77 CNR1 (0.70) CNR1CYP2C9
SCHEMBL4885513 0.76 CNR1 (0.82) CNR1
SCHEMBL4888981 0.74 CNR1 (0.68) CNR1
SCHEMBL4887045 0.72 CNR1 (0.79) CNR1
SCHEMBL4888334 0.72 CNR1 (0.70) CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200527-A1 Cannabinoid Receptor Modulators CAREX SA (FR) 2008-08-21 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 (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-20080200527-A1 Cannabinoid Receptor Modulators CNR1, CNR2, HCRTR2 CNR1 1/4885ALDH1A1 2431/4885CYP1A2 1319/4885

“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.