SCHEMBL3274249

SCHEMBL3274249

O=C(NCC(=O)N1CCC(O)CC1)c1ccc(S(=O)(=O)Nc2ccccc2Oc2ccc(F)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 3/20 0.49
CACNA1B Q00975 3/20 0.49
GAA P10253 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
BCL2L1 Q07817 1/20 0.43
MCL1 Q07820 1/20 0.43
KMT2A Q03164 2/20 0.42
MRGPRX1 Q96LB2 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
HBB P68871 1/20 0.41
HSD17B10 Q99714 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
SCHEMBL3278221 0.94 NPC1 (0.47) CACNA1HCACNA1BGAANPC1RAB9A
SCHEMBL3280640 0.93 CACNA1H (0.52) CACNA1HCACNA1BGAANPC1RAB9A
SCHEMBL15103825 0.92 CCR2 (0.45) CACNA1HCACNA1BGAANPC1RAB9A
SCHEMBL3274292 0.92 PREP (0.47) CACNA1HCACNA1BGAANPC1RAB9A
SCHEMBL15103781 0.92 CACNA1H (0.47) CACNA1HCACNA1BGAANPC1RAB9A
SCHEMBL15104149 0.91 CACNA1H (0.47) CACNA1HCACNA1BGAANPC1RAB9A
SCHEMBL15104080 0.90 GAA (0.51) CACNA1HCACNA1BGAANPC1RAB9A
SCHEMBL15104131 0.89 NPC1 (0.49) CACNA1HCACNA1BGAANPC1RAB9A
SCHEMBL3274430 0.88 CCR2 (0.44) KMT2ASMN1; SMN2HSD17B10
SCHEMBL15103922 0.86 SMN1; SMN2 (0.48) CACNA1HCACNA1BGAANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481527-B2 Benzamide derivatives as bradykinin antagonists RICHTER GEDEON NYRT. (HU) 2013-07-09 US claimed
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 CACNA1H 997/4885CACNA1B 915/4885GAA 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.