SCHEMBL4000321

SCHEMBL4000321

CN1CCCN(C(=O)CN2CCNCC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
BIRC2 Q13490 1/20 0.49
CHRM5 P08912 1/20 0.45
CHRM3 P20309 1/20 0.45
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
HTT P42858 1/20 0.42
LMNA P02545 2/20 0.41
PHGDH O43175 1/20 0.41
SIGMAR1 Q99720 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL1906248 0.93 GAA (0.52) GAABIRC2CHRM5CHRM3TDP1
SCHEMBL11952852 0.86 GAA (0.47) GAABIRC2CHRM5CHRM3KMT2A
SCHEMBL4000255 0.86 ITGB3 (0.46) KMT2ATDP1HTTLMNAPHGDH
SCHEMBL209616 0.84 GAA (0.63) GAABIRC2CHRM5CHRM3KMT2A
SCHEMBL6963350 0.84 GAA (0.63) GAABIRC2CHRM5CHRM3KMT2A
SCHEMBL13621203 0.83 GAA (0.62) GAABIRC2KMT2ATDP1ALOX15
Hydrochloric Acid SCHEMBL27822626 0.83 GAA (0.61) GAABIRC2CHRM5CHRM3KMT2A
SCHEMBL254801 0.83 GAA (0.67) GAABIRC2CHRM5CHRM3KMT2A
SCHEMBL4464858 0.82 GAA (0.52) GAAKMT2ATDP1ALOX15TSHR
SCHEMBL12569136 0.81 GAA (0.76) GAABIRC2TDP1ALOX15TSHR

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
EP-1606288-B1 BENZENESULPHONAMIDE DERIVATIVES, METHOD FOR PRODUCTION AND USE THEREOF FOR TREATMENT OF PAIN FOURNIER LAB SA (FR) 2009-06-03 EP disclosed
US-7538111-B2 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LABORATOIRES FOURNIER S.A. (FR) 2009-05-26 US disclosed
US-20060178360-A1 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LABORATOIRES FOURNIER S.A. (FR) 2006-08-10 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-20060178360-A1 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LTB4R2, BDKRB2, TBXA2R GAA 1470/4885BIRC2 2767/4885CHRM5 3258/4885

“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.