SCHEMBL9909246

SCHEMBL9909246

COc1ccc(-c2c(Cl)cnc3ccc(C(=O)N=C(N)N)cc23)c(Cl)c1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 16/20 0.66
KDM4E B2RXH2 1/20 0.39
HPGDS O60760 1/20 0.39
HTR7 P34969 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL9909248 0.91 HTR5A (0.77) HTR5A
SCHEMBL9909287 0.88 HTR5A (0.59) HTR5A
SCHEMBL9907889 0.86 HTR5A (0.69) HTR5AHTR7HTR2B
SCHEMBL9909184 0.85 HTR5A (0.45) HTR5AKDM4E
SCHEMBL9909240 0.85 HTR5A (0.64) HTR5AHTR7HTR2B
SCHEMBL9909273 0.84 HTR5A (0.44) HTR5AHPGDS
SCHEMBL9907873 0.83 HTR5A (0.70) HTR5AHTR7HTR2B
SCHEMBL9909304 0.82 HTR5A (0.65) HTR5A
SCHEMBL9909236 0.82 HTR5A (0.61) HTR5AHTR7HTR2B
SCHEMBL9907874 0.81 HTR5A (0.68) HTR5AHTR7HTR2B

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 1/4885KDM4E 1474/4885HPGDS 3951/4885

“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.