SCHEMBL3148950

SCHEMBL3148950

O=C(N[C@H]1CC[C@H](CCN2CCCC2)CC1)c1ccc(S(=O)(=O)Nc2ccccc2Oc2ccc(F)cc2Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGDR Q13258 2/20 0.51
PTGDR2 Q9Y5Y4 2/20 0.51
CCR2 P41597 9/20 0.47
DRD3 P35462 5/20 0.46
HTR2A P28223 4/20 0.46
KCNH2 Q12809 1/20 0.46
DRD2 P14416 2/20 0.45
RAB9A P51151 1/20 0.45
BDKRB1 P46663 1/20 0.44

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
SCHEMBL3148943 1.00 PTGDR (0.51) PTGDRPTGDR2CCR2DRD3HTR2A
SCHEMBL3049324 0.94 CCR2 (0.46) PTGDRPTGDR2CCR2DRD3HTR2A
SCHEMBL3050733 0.94 CCR2 (0.46) PTGDRPTGDR2CCR2DRD3HTR2A
SCHEMBL3143241 0.93 PTGDR (0.55) PTGDRPTGDR2CCR2DRD3HTR2A
SCHEMBL3143246 0.93 PTGDR (0.55) PTGDRPTGDR2CCR2DRD3HTR2A
SCHEMBL3149310 0.90 CCR2 (0.49) PTGDRPTGDR2CCR2DRD3HTR2A
SCHEMBL3149304 0.90 CCR2 (0.49) PTGDRPTGDR2CCR2DRD3HTR2A
SCHEMBL3143685 0.87 CCR2 (0.56) PTGDRPTGDR2CCR2DRD3DRD2
SCHEMBL3143680 0.87 CCR2 (0.56) PTGDRPTGDR2CCR2DRD3DRD2
SCHEMBL15103930 0.87 CCR2 (0.47) PTGDRPTGDR2CCR2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PTGDR 48/4885PTGDR2 83/4885CCR2 417/4885

“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.