SCHEMBL6339283

SCHEMBL6339283

CN(CCc1ccccc1)C(=O)Nc1ccc2c(c1)-c1ccccc1S2(=O)=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.57
ROCK2 O75116 1/20 0.56
ROCK1 Q13464 1/20 0.56
CA12 O43570 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
CA9 Q16790 2/20 0.54
ABCC9 O60706 1/20 0.50
ABCC8 Q09428 1/20 0.50
KCNJ11 Q14654 1/20 0.50
KCNJ8 Q15842 1/20 0.50
MAOA P21397 2/20 0.49
EPHX2 P34913 1/20 0.45
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
TP53 P04637 1/20 0.41
TACR1 P25103 1/20 0.41
MTOR P42345 2/20 0.41
LTB4R Q15722 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
SCHEMBL5120468 0.91 ROCK2 (0.50) NPY5RROCK2ROCK1CA12CA1
SCHEMBL29140944 0.77 NPY5R (0.78) NPY5RROCK2ROCK1CA12CA1
SCHEMBL5111868 0.75 MAOA (0.81) CA12CA1CA2CA9ABCC9
SCHEMBL7007931 0.73 MAPT (0.47) OPRM1OPRD1OPRK1TP53
SCHEMBL15147814 0.72 ROCK2 (1.00) NPY5RROCK2ROCK1CA12CA1
SCHEMBL5120127 0.72 ALDH1A1 (0.57) ROCK2ROCK1ABCC9ABCC8KCNJ11
SCHEMBL5116247 0.71 ABCC9 (0.60) ABCC9ABCC8KCNJ11KCNJ8MAOA
SCHEMBL5110631 0.71 LMNA (0.55) NPY5RROCK2ABCC9ABCC8KCNJ11
SCHEMBL8472195 0.68 NPY5R (0.59) NPY5RROCK2ROCK1CA12CA1
SCHEMBL5113896 0.67 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6967216-B2 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by NP Y5 receptor ASTRAZENECA AB (SE) 2005-11-22 US claimed
US-20030225097-A1 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by np y5 receptor ASTRAZENECA AB (SE) 2003-12-04 US 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-20030225097-A1 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by np y5 receptor NPY5R, NPY1R, NPY2R NPY5R 1/4885ROCK2 3235/4885ROCK1 2944/4885

“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.