SCHEMBL9907899

SCHEMBL9907899

Cc1nc2ccc(C(=O)N=C(N)N)cc2c(-c2ccc(F)cc2Cl)c1C

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 14/20 0.69
GRM2 Q14416 1/20 0.42
HTR2B P41595 2/20 0.39
MPO P05164 1/20 0.39
PTPN11 Q06124 1/20 0.39
HTR7 P34969 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
SCHEMBL9907902 0.92 HTR5A (0.60) HTR5AGRM2HTR2BMPOPTPN11
SCHEMBL9907886 0.90 HTR5A (0.78) HTR5AHTR2BMPOHTR7
SCHEMBL9907898 0.86 HTR5A (0.64) HTR5AHTR2BHTR7
SCHEMBL9907644 0.86 HTR5A (0.48) HTR5AGRM2PTPN11
SCHEMBL9907895 0.84 HTR5A (0.76) HTR5AMPO
SCHEMBL9907907 0.84 HTR5A (0.60) HTR5AHTR2BHTR7
SCHEMBL9907831 0.84 HTR5A (0.71) HTR5A
SCHEMBL9907868 0.84 HTR5A (0.68) HTR5AMPO
SCHEMBL9907883 0.82 HTR5A (0.73) HTR5AHTR2BHTR7
SCHEMBL9108054 0.82 HTR5A (1.00) HTR5A

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
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
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 1/4885GRM2 109/4885HTR2B 6/4885

“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.