SCHEMBL4394362

SCHEMBL4394362

O=C(Cc1n[nH]c2ccccc12)N1CCN(S(=O)(=O)c2cc(Cl)cc(Cl)c2)CC1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.63
ALDH1A1 P00352 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
TSHR P16473 2/20 0.50
GAA P10253 2/20 0.50
MAPT P10636 2/20 0.50
MEN1 O00255 1/20 0.50
USP2 O75604 1/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
PKM P14618 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL4264994 0.78 CNR1 (1.00) CNR1ALDH1A1TSHRGAAKMT2A
SCHEMBL4269163 0.77 CNR1 (0.76) CNR1ALDH1A1GAAMAPTKMT2A
SCHEMBL4275750 0.76 CNR1 (0.73) CNR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL4275746 0.75 CNR1 (1.00) CNR1ALDH1A1NPSR1PKMSMN1; SMN2
SCHEMBL4267226 0.74 CNR1 (0.83) CNR1GAALMNAPKM
SCHEMBL4273804 0.74 CNR1 (0.82) CNR1ALDH1A1GAAMEN1KMT2A
SCHEMBL4265856 0.72 CNR1 (0.76) CNR1ALDH1A1GAAMAPTLMNA
SCHEMBL4269684 0.72 CNR1 (0.80) CNR1GAAPKM
SCHEMBL4269168 0.72 CNR1 (0.68) CNR1GAAMAPTLMNAKMT2A
SCHEMBL4274692 0.72 TDP1 (0.72) CNR1ALDH1A1NPSR1TSHRGAA

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 1/4885ALDH1A1 2921/4885NPSR1 12/4885

“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.