SCHEMBL3148959

SCHEMBL3148959

O=C(NCCN1CCN(c2ccccn2)CC1)c1ccc(S(=O)(=O)N(Oc2ccc(Br)cc2)c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.52
SLC6A4 P31645 1/20 0.49
DRD3 P35462 3/20 0.48
KDM4E B2RXH2 1/20 0.47
ADRB2 P07550 1/20 0.47
HSD17B10 Q99714 1/20 0.47
DRD2 P14416 2/20 0.45
HRH3 Q9Y5N1 3/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42

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
SCHEMBL3149616 0.92 DRD2 (0.47) DRD4DRD3KDM4EDRD2CA1
SCHEMBL3145428 0.92 DRD4 (0.51) DRD4SLC6A4DRD3KDM4EADRB2
SCHEMBL3154562 0.90 DRD4 (0.54) DRD4SLC6A4DRD3HSD17B10DRD2
SCHEMBL3145296 0.89 RAB9A (0.48) DRD3DRD2
SCHEMBL3149381 0.89 DRD4 (0.52) DRD4SLC6A4DRD3DRD2
SCHEMBL3154044 0.89 HTR1A (0.55) DRD4DRD3DRD2CA9
SCHEMBL3139317 0.86 CA1 (0.49) DRD4DRD3KDM4EDRD2CA1
SCHEMBL3153359 0.84 DRD3 (0.57) DRD4DRD3DRD2HRH3
SCHEMBL3138062 0.83 PLD2 (0.44) DRD4DRD3KDM4EHSD17B10DRD2
SCHEMBL15016168 0.83 DRD4 (0.49) DRD4SLC6A4DRD3KDM4EHSD17B10

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 DRD4 820/4885SLC6A4 1587/4885DRD3 467/4885

“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.