SCHEMBL4276701

SCHEMBL4276701

O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc(F)c3ccccc23)CC1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.62
ALDH1A1 P00352 2/20 0.61
TSHR P16473 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.52
ATM Q13315 1/20 0.52
ALOX5AP P20292 1/20 0.52
FEN1 P39748 1/20 0.52
GAA P10253 1/20 0.50
NPSR1 Q6W5P4 1/20 0.48
PKM P14618 1/20 0.48

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
SCHEMBL4268592 0.86 CNR1 (0.65) CNR1ATMNPSR1
SCHEMBL4265032 0.85 CNR1 (0.62) CNR1ALDH1A1TSHRATMGAA
SCHEMBL4274699 0.82 CNR1 (0.88) CNR1ATM
SCHEMBL4264827 0.79 CNR1 (0.70) CNR1ALDH1A1ATMNPSR1
SCHEMBL4271835 0.78 CNR1 (0.76) CNR1ATM
SCHEMBL4265898 0.78 CNR1 (0.98) CNR1ALDH1A1ATMNPSR1
SCHEMBL14919615 0.77 ALDH1A1 (1.00) ALDH1A1TSHRATMGAANPSR1
SCHEMBL4267164 0.77 CNR1 (1.00) CNR1ALDH1A1ATMNPSR1
SCHEMBL15916027 0.76 CNR1 (0.60) CNR1ALDH1A1ATM
SCHEMBL4270468 0.75 CNR1 (0.76) CNR1ALDH1A1ATMNPSR1

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-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
EP-2056828-A2 SULFONYLATED PIPERAZINES AS CANNABINOID-1 RECEPTOR MODULATORS Merck & Co., Inc. (US) 2009-05-13 EP disclosed
WO-2008024284-A2 SULFONYLATED PIPERAZINES AS CANNABINOID-1 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2008-02-28 WO 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-20090247499-A1 SULFONYLATED PIPERAZINES AS CANNABINOID-1 RECEPTOR MODULATORS CNR1, CNR2, FAAH CNR1 1/4885ALDH1A1 2921/4885TSHR 784/4885

“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.