SCHEMBL3139293

SCHEMBL3139293

O=C(NCCN1CCN(c2ncccn2)CC1)c1ccc(S(=O)(=O)Nc2ccccc2Oc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 6/20 0.51
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
HTR1A P08908 1/20 0.46
ADRA1A P35348 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL3149584 0.94 CCR2 (0.50) CCR2CA1CA2CA7KDM4E
SCHEMBL3153707 0.92 CCR2 (0.53) CCR2HTR1A
SCHEMBL3145183 0.91 CCR2 (0.51) CCR2CA1CA2CA7
SCHEMBL3153261 0.90 CCR2 (0.59) CCR2KDM4EALDH1A1GAATSHR
SCHEMBL3138194 0.88 DRD4 (0.46) CCR2KDM4EALDH1A1GAATSHR
SCHEMBL3149352 0.87 CCR2 (0.65) CCR2ALDH1A1GAASMN1; SMN2
SCHEMBL3138029 0.86 CCR2 (0.53) CCR2HTR1A
SCHEMBL3155058 0.86 CCR2 (0.49) CCR2HTR1AKDM4EALDH1A1GAA
SCHEMBL3148937 0.86 DRD4 (0.51) CCR2GAASMN1; SMN2
SCHEMBL3139502 0.86 ALDH1A1 (0.52) CCR2KDM4EALDH1A1GAATSHR

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 CCR2 417/4885CA1 1474/4885CA2 762/4885

“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.