SCHEMBL9907852

SCHEMBL9907852

Cc1ccc(-c2ccnc3c(C)cc(C(=O)N=C(N)N)cc23)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 11/20 0.41
CDC7 O00311 1/20 0.37
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
DBF4 Q9UBU7 1/20 0.37
SLC9A1 P19634 3/20 0.37
LIMK1 P53667 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL9907827 0.91 SLC9A1 (0.42) HTR5ASLC9A1
SCHEMBL9907823 0.89 HTR5A (0.54) HTR5ASLC9A1
SCHEMBL15500584 0.89 PTGDR2 (0.35) HTR5ACDC7CCNE1CDK2DBF4
SCHEMBL9909233 0.88 CDC7 (0.39) HTR5ACDC7CCNE1CDK2DBF4
SCHEMBL9907850 0.87 HTR5A (0.44) HTR5ASLC9A1
SCHEMBL9907859 0.86 HTR2B (0.42) HTR5ASLC9A1
SCHEMBL9907495 0.84 PTGDR2 (0.41) CDC7CCNE1CDK2DBF4LIMK1
SCHEMBL9907828 0.84 HTR5A (0.44) HTR5ASLC9A1
SCHEMBL9907837 0.83 HTR5A (0.47) HTR5ASLC9A1PTGDR2
SCHEMBL9907846 0.83 HTR5A (0.47) HTR5ASLC9A1

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 1/4885CDC7 4154/4885CCNE1 3775/4885

“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.