SCHEMBL3273945

SCHEMBL3273945

CN(C)CCN1CCN(C(=O)CNC(=O)c2ccc(S(=O)(=O)Nc3ccccc3Oc3ccccc3)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 5/20 0.52
CACNA1B Q00975 5/20 0.52
CCR2 P41597 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
LIMK2 P53671 1/20 0.41
PTGDR2 Q9Y5Y4 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL3277917 0.95 CACNA1B (0.55) CACNA1HCACNA1BCCR2TDP1LIMK2
SCHEMBL3275330 0.92 CACNA1H (0.45) CACNA1HCACNA1BCCR2TDP1PTGDR2
SCHEMBL3274979 0.90 CCR2 (0.50) CACNA1HCACNA1BCCR2TDP1PTGDR2
SCHEMBL15103772 0.89 TDP1 (0.47) CACNA1HCACNA1BTDP1LIMK2PTGDR2
SCHEMBL3278520 0.88 CCR2 (0.49) CACNA1HCACNA1BCCR2PTGDR2MEN1
SCHEMBL15103910 0.88 TDP1 (0.47) CACNA1HCACNA1BCCR2TDP1PTGDR2
SCHEMBL15103784 0.87 CACNA1H (0.46) CACNA1HCACNA1BTDP1PTGDR2L3MBTL1
SCHEMBL3274577 0.87 CCR2 (0.47) CCR2PTGDR2KMT2ASMN1; SMN2
SCHEMBL15103838 0.86 CCR2 (0.42) CACNA1HCACNA1BCCR2TDP1PTGDR2
SCHEMBL15103767 0.86 HSD17B10 (0.50) CACNA1HCACNA1BCCR2TDP1PTGDR2

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 CACNA1H 997/4885CACNA1B 915/4885CCR2 380/4885

“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.