SCHEMBL9907770

SCHEMBL9907770

Cc1cccc(C)c1-c1ncc(Cl)c2ccc(C(=O)O)cc12

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 7/20 0.55
PLAU P00749 4/20 0.48
SLC22A12 Q96S37 7/20 0.46
PLG P00747 2/20 0.43
MRGPRX4 Q96LA9 1/20 0.40
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40

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
SCHEMBL9907659 0.92 HTR5A (0.64) HTR5APLAUSLC22A12PLG
SCHEMBL9908010 0.90 HTR5A (0.49) HTR5APLAUSLC22A12PLGMRGPRX4
SCHEMBL9907766 0.86 HTR5A (0.52) HTR5ACSNK2A2CSNK2B
SCHEMBL9907768 0.86 CSNK2A2 (0.52) HTR5APLAUSLC22A12PLGCSNK2A2
SCHEMBL9908014 0.85 HTR5A (0.54) HTR5APLAUPLG
SCHEMBL9907658 0.84 HTR5A (0.71) HTR5APLAUCSNK2A2CSNK2B
SCHEMBL9908016 0.84 HTR5A (0.47) HTR5APLAUSLC22A12PLGMRGPRX4
SCHEMBL9907982 0.84 HTR5A (0.78) HTR5A
SCHEMBL9907762 0.84 HTR5A (0.62) HTR5ASLC22A12
SCHEMBL9909315 0.84 HTR5A (0.50) HTR5APLAUPLGMRGPRX4

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 6 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
EP-2463276-B1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC (JP) 2014-03-12 EP 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
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 3322/4885SLC22A12 1751/4885

“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.