SCHEMBL3281457

SCHEMBL3281457

O=C(NCC(=O)N1CCCCC1)c1ccc(S(=O)(=O)Nc2cc(F)ccc2Oc2ccc(F)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 9/20 0.53
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
GAA P10253 2/20 0.44
MRGPRX1 Q96LB2 1/20 0.43
THRA P10827 1/20 0.43
MEN1 O00255 1/20 0.42
HBB P68871 1/20 0.42
KMT2A Q03164 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
SCHEMBL15104075 1.00 CCR2 (0.53) CCR2SMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL15104080 0.92 GAA (0.51) CCR2SMN1; SMN2LMNAALDH1A1HPGD
Hydrochloric Acid SCHEMBL3274971 0.91 CCR2 (0.45) CCR2SMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL15103825 0.91 CCR2 (0.45) CCR2SMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL15104012 0.89 CCR2 (0.44) CCR2SMN1; SMN2LMNAGAAMRGPRX1
SCHEMBL15103823 0.88 LMNA (0.52) CCR2SMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL15085687 0.88 CCR2 (0.52) CCR2
SCHEMBL15104073 0.88 CCR2 (0.44) CCR2GAAMRGPRX1
SCHEMBL15103733 0.85 GAA (0.51) CCR2SMN1; SMN2LMNAALDH1A1HPGD
SCHEMBL15103796 0.85 GAA (0.51) CCR2SMN1; SMN2LMNAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2076491-B1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT (HU) 2013-07-17 EP disclosed
US-8481527-B2 Benzamide derivatives as bradykinin antagonists RICHTER GEDEON NYRT. (HU) 2013-07-09 US disclosed
US-20100087423-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-04-08 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-20100087423-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS BDKRB1, BDKRB2, HRH1 CCR2 380/4885SMN1; SMN2 4508/4885LMNA 1316/4885

“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.