SCHEMBL3277546

SCHEMBL3277546

O=C(NCC(=O)N1CCC(CCN2CCCC2)CC1)c1ccc(S(=O)(=O)Nc2ccccc2Oc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 7/20 0.47
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
RAB9A P51151 1/20 0.46
CHRM4 P08173 1/20 0.44
USP5 P45974 1/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
USP30 Q70CQ3 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
CACNA1H O95180 1/20 0.41
CACNA1B Q00975 1/20 0.41

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
SCHEMBL3274979 0.91 CCR2 (0.50) CCR2NPC1GAARAB9ACNR1
SCHEMBL15103945 0.90 NPC1 (0.47) NPC1GAARAB9ACHRM4USP5
SCHEMBL3278520 0.89 CCR2 (0.49) CCR2NPC1GAARAB9ACNR1
SCHEMBL3274506 0.89 GAA (0.45) NPC1GAARAB9AUSP5CNR1
SCHEMBL15103767 0.89 HSD17B10 (0.50) CCR2NPC1GAARAB9ACNR1
SCHEMBL15085687 0.88 CCR2 (0.52) CCR2
SCHEMBL15103796 0.88 GAA (0.51) CCR2NPC1GAARAB9ACNR1
SCHEMBL15103733 0.88 GAA (0.51) CCR2NPC1GAARAB9ACNR1
SCHEMBL15103780 0.88 GAA (0.51) CCR2NPC1GAARAB9ACNR1
SCHEMBL3278221 0.87 NPC1 (0.47) NPC1GAARAB9AUSP5CNR1

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 6 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 claimed
US-8481527-B2 Benzamide derivatives as bradykinin antagonists RICHTER GEDEON NYRT. (HU) 2013-07-09 US claimed
US-20100087423-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-04-08 US claimed
EP-2076491-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS Richter Gedeon NYRT (HU) 2009-07-08 EP claimed
WO-2008068540-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2008-06-12 WO claimed
EP-2076491-B1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT (HU) 2013-07-17 EP 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 380/4885NPC1 2456/4885GAA 3731/4885

“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.