SCHEMBL9909249

SCHEMBL9909249

N#Cc1ccc(-c2c(Cl)cnc3ccc(C(=O)N=C(N)N)cc23)cc1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 14/20 0.59
PLAU P00749 2/20 0.46
PLG P00747 1/20 0.39
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
MTOR P42345 1/20 0.39
PIK3CG P48736 1/20 0.39
PRKDC P78527 1/20 0.39
ATM Q13315 1/20 0.39
ATR Q13535 1/20 0.39
MAP2 P11137 1/20 0.38

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
SCHEMBL12875082 0.92 HTR5A (0.50) HTR5APLAUPLGPIK3CAPIK3CB
SCHEMBL9907871 0.86 HTR5A (0.62) HTR5APLAUPLG
SCHEMBL9907855 0.86 HTR5A (0.75) HTR5A
SCHEMBL9907856 0.85 HTR5A (0.65) HTR5APLAU
SCHEMBL9909288 0.85 HTR5A (0.77) HTR5APIK3CAPIK3CBMTORPIK3CG
SCHEMBL9909267 0.84 SLC22A12 (0.52) HTR5APLAUMAP2
SCHEMBL9907876 0.83 HTR5A (0.59) HTR5APLAU
SCHEMBL9909287 0.83 HTR5A (0.59) HTR5APLAUPLG
SCHEMBL9909242 0.83 HTR5A (0.59) HTR5APLAUPLGPIK3CAPIK3CB
SCHEMBL7908713 0.82 HTR5A (0.41) HTR5APLAUMAP2

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 2 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
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 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-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE HTR5A, HTR2A, HTR1E HTR5A 1/4885PLAU 3322/4885PLG 3328/4885

“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.