SCHEMBL9909194

SCHEMBL9909194

COc1cc(F)ccc1-c1ncc(Cl)c2ccc(C(=O)O)cc12

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 3/20 0.54
PLG P00747 1/20 0.49
PLAU P00749 1/20 0.49
CCNT1 O60563 1/20 0.46
CDK9 P50750 1/20 0.46
SCN9A Q15858 7/20 0.44
SCN5A Q14524 1/20 0.43
PYGL P06737 1/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
HSP90AA1 P07900 1/20 0.41
KCNQ3 O43525 1/20 0.41
KCNQ2 O43526 1/20 0.41
CTSA P10619 2/20 0.41
LRRK2 Q5S007 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
SCHEMBL9909295 0.91 PLG (0.54) HTR5APLGPLAUPYGLLMNA
SCHEMBL9909286 0.90 HTR5A (0.53) HTR5ACCNT1CDK9SCN9ASCN5A
SCHEMBL9909200 0.89 PLAU (0.51) HTR5APLGPLAUSCN9APYGL
SCHEMBL9909195 0.89 HTR5A (0.51) HTR5ACCNT1CDK9SCN9ASCN5A
SCHEMBL9907688 0.86 HTR5A (0.60) HTR5APLGPLAUPYGLMAPK1
SCHEMBL9909258 0.86 HTR5A (0.76) HTR5APLGPLAU
SCHEMBL9907678 0.85 HTR5A (0.57) HTR5APLGPLAUMAPK1
SCHEMBL9907733 0.85 HTR5A (0.72) HTR5APLAU
SCHEMBL9909283 0.84 PLAU (0.49) HTR5APLGPLAUSCN9ALRRK2
SCHEMBL9908017 0.83 HTR5A (0.54) HTR5APLGPLAUMAPK1KCNQ3

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-8853242-B2 Nitrogenous-ring acylguanidine derivative ASTELLAS PHARMA INC. (JP) 2014-10-07 US disclosed
EP-2463276-B1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC (JP) 2014-03-12 EP disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US disclosed
WO-2011016504-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE アステラス製薬株式会社 (JP) 2011-02-10 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-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E HTR5A 1/4885PLG 3328/4885PLAU 3322/4885

“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.