SCHEMBL2714869

SCHEMBL2714869

CCNC(=O)c1cc(C(=O)O)ccn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 10/20 0.61
ALKBH5 Q6P6C2 6/20 0.61
KDM4E B2RXH2 4/20 0.61
KDM5C P41229 3/20 0.61
KDM5A P29375 3/20 0.61
KDM4D Q6B0I6 2/20 0.61
KDM6B O15054 2/20 0.61
KDM4C Q9H3R0 2/20 0.61
KDM2A Q9Y2K7 2/20 0.61
KDM3A Q9Y4C1 2/20 0.61
KDM5B Q9UGL1 2/20 0.61
TET3 O43151 1/20 0.61
KDM4A O75164 1/20 0.61
BBOX1 O75936 1/20 0.61
ALDH1A1 P00352 1/20 0.61
MAPT P10636 1/20 0.61
ASPH Q12797 1/20 0.61
TET2 Q6N021 1/20 0.61
KDM7A Q6ZMT4 1/20 0.61
KDM8 Q8N371 1/20 0.61

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
SCHEMBL29831092 1.00 FTO (0.61) FTOALKBH5KDM4EKDM5CKDM5A
SCHEMBL4353042 0.90 ITGB3 (0.47) FTOALKBH5KDM4EKDM5CKDM5A
SCHEMBL2713556 0.87 KDM4E (0.61) FTOALKBH5KDM4EKDM5CKDM5A
SCHEMBL5215154 0.87 FTO (0.61) FTOALKBH5KDM4EKDM5CKDM5A
SCHEMBL19439177 0.86 PARP1 (0.43) FTOALKBH5KDM4EKDM5CKDM5A
SCHEMBL2714272 0.84 KDM4E (0.51) FTOALKBH5KDM4EKDM5CKDM5A
SCHEMBL29831193 0.83 SMYD3 (0.55) BRD4ITGB3ITGA2B
SCHEMBL13383551 0.83 KDM4E (0.69) KDM4EKDM5CKDM5AKDM6BKDM4C
SCHEMBL29830791 0.81 FTO (0.67) FTOALKBH5KDM4EKDM5CKDM5A
SCHEMBL19439262 0.81 FTO (0.67) FTOALKBH5KDM4EKDM5CKDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106478497-B Arylamine derivatives as TTX-S blockers 拉夸里亚创药株式会社 2020-05-08 CN disclosed
CN-108884070-A PYRIDYL DERIVATIVES AS BROMODOMAIN INHIBITORS 葛兰素史克知识产权第二有限公司 2018-11-23 CN disclosed
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP disclosed
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP disclosed
CN-103249721-B Arylamine Derivatives as TTX-S Blockers 拉夸里亚创药株式会社 2016-10-12 CN disclosed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 US disclosed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
EP-2630122-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RaQualia Pharma Inc (JP) 2013-08-28 EP disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 WO disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 WO 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-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS SCN2B, SCN1B, SCN2A FTO 1674/4885ALKBH5 2336/4885KDM4E 1168/4885

“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.