SCHEMBL9909304

SCHEMBL9909304

COc1ccc(-c2ncc(Cl)c3ccc(C(=O)N=C(N)N)cc23)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 16/20 0.65
PLAU P00749 3/20 0.45
PLG P00747 2/20 0.45
CDC7 O00311 1/20 0.41
CCNT1 O60563 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CCNE1 P24864 1/20 0.41
CDK2 P24941 1/20 0.41
CSNK1A1 P48729 1/20 0.41
CSNK1D P48730 1/20 0.41
CDK9 P50750 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41
DBF4 Q9UBU7 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
SCHEMBL9908045 0.91 HTR5A (0.76) HTR5ACDC7CCNT1CSNK2A2CCNE1
SCHEMBL9908033 0.91 HTR5A (0.76) HTR5APLAUPLG
SCHEMBL9907941 0.86 HTR5A (0.69) HTR5APLAUPLG
SCHEMBL9907971 0.86 HTR5A (0.71) HTR5A
SCHEMBL9909177 0.85 PLAU (0.47) HTR5APLAUPLGCDC7CCNT1
SCHEMBL9909292 0.84 HTR5A (0.64) HTR5APLAUPLG
SCHEMBL9907940 0.84 HTR5A (0.86) HTR5APLAU
SCHEMBL9909276 0.84 HTR5A (0.43) HTR5APLAUPLGCDC7CCNT1
SCHEMBL9909258 0.83 HTR5A (0.76) HTR5APLAUPLG
SCHEMBL9908035 0.82 HTR5A (0.76) HTR5APLAUPLG

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 3 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
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 1/4885PLAU 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.