SCHEMBL3140964

SCHEMBL3140964

O=C(N[C@H]1CC[C@H](CCN2CCCC2)CC1)c1ccc(S(=O)(=O)Nc2ccccc2C(=O)c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.49
DRD3 P35462 9/20 0.49
HTR2A P28223 7/20 0.49
BDKRB1 P46663 1/20 0.47
KCNH2 Q12809 1/20 0.47
GPR27 Q9NS67 2/20 0.45
CCR2 P41597 2/20 0.44
KCNA5 P22460 1/20 0.44
SLC6A12 P48065 1/20 0.43

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
SCHEMBL3140960 1.00 DRD2 (0.49) DRD2DRD3HTR2ABDKRB1KCNH2
SCHEMBL3059294 0.93 DRD2 (0.44) DRD2DRD3HTR2ABDKRB1KCNH2
SCHEMBL3059290 0.93 DRD2 (0.44) DRD2DRD3HTR2ABDKRB1KCNH2
SCHEMBL15103718 0.87 BDKRB1 (0.44) BDKRB1KCNH2GPR27CCR2
SCHEMBL3147694 0.87 BDKRB1 (0.61) DRD2DRD3HTR2ABDKRB1KCNH2
SCHEMBL3147702 0.87 BDKRB1 (0.61) DRD2DRD3HTR2ABDKRB1KCNH2
SCHEMBL3143241 0.87 PTGDR (0.55) DRD2DRD3HTR2ABDKRB1KCNH2
SCHEMBL3143246 0.87 PTGDR (0.55) DRD2DRD3HTR2ABDKRB1KCNH2
SCHEMBL3148934 0.82 CCR2 (0.56) DRD2DRD3HTR2ABDKRB1KCNH2
SCHEMBL3148931 0.82 CCR2 (0.56) DRD2DRD3HTR2ABDKRB1KCNH2

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
EP-2074083-B1 NEW SULFONAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT (HU) 2013-06-19 EP disclosed
US-20100075978-A1 SULFONAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-03-25 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-20100075978-A1 SULFONAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS BDKRB1, BDKRB2, TRPV1 DRD2 424/4885DRD3 467/4885HTR2A 985/4885

“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.