SCHEMBL4386367

SCHEMBL4386367

O=C(CCc1ccc(C(F)(F)F)cc1)N1CCN(S(=O)(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.82

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 13/20 0.82
L3MBTL1 Q9Y468 1/20 0.60
HRH3 Q9Y5N1 2/20 0.57
KCNH2 Q12809 3/20 0.54
ALDH1A1 P00352 2/20 0.52
PKM P14618 2/20 0.52
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL4271444 0.90 CNR1 (1.00) CNR1HRH3ALDH1A1PKMLMNA
SCHEMBL4265815 0.88 CNR1 (1.00) CNR1L3MBTL1HRH3KCNH2
SCHEMBL9951843 0.85 PKM (0.73) CNR1HRH3ALDH1A1PKMLMNA
SCHEMBL4267203 0.81 CNR1 (1.00) CNR1L3MBTL1HRH3KCNH2
SCHEMBL13671936 0.81 CNR1 (0.85) CNR1L3MBTL1HRH3KCNH2PKM
SCHEMBL4271964 0.79 CNR1 (0.82) CNR1L3MBTL1HRH3KCNH2
SCHEMBL4266711 0.78 CNR1 (0.80) CNR1L3MBTL1HRH3KCNH2
SCHEMBL4275563 0.78 CNR1 (1.00) CNR1L3MBTL1HRH3KCNH2
SCHEMBL4270476 0.78 CNR1 (0.80) CNR1L3MBTL1HRH3KCNH2
SCHEMBL22813668 0.78 HRH3 (0.67) CNR1HRH3ALDH1A1LMNA

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-20090247499-A1 SULFONYLATED PIPERAZINES AS CANNABINOID-1 RECEPTOR MODULATORS MERCK SHARP & DOHME CORP. 2009-10-01 US claimed
EP-2056828-A2 SULFONYLATED PIPERAZINES AS CANNABINOID-1 RECEPTOR MODULATORS Merck & Co., Inc. (US) 2009-05-13 EP claimed
WO-2008024284-A2 SULFONYLATED PIPERAZINES AS CANNABINOID-1 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2008-02-28 WO claimed

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-20090247499-A1 SULFONYLATED PIPERAZINES AS CANNABINOID-1 RECEPTOR MODULATORS CNR1, CNR2, FAAH CNR1 1/4885L3MBTL1 3894/4885HRH3 233/4885

“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.