SCHEMBL9907997

SCHEMBL9907997

COc1cc(F)c(-c2ncc(Cl)c3ccc(C(=O)O)cc23)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 11/20 0.53
PLAU P00749 2/20 0.44
PLG P00747 1/20 0.44
LMNA P02545 2/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
CTSA P10619 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ACLY P53396 1/20 0.38
RXRA P19793 1/20 0.38
LRRK2 Q5S007 1/20 0.38

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
SCHEMBL9907998 0.90 HTR5A (0.52) HTR5ACTSAACLY
SCHEMBL9907447 0.87 HTR5A (0.58) HTR5APLAUPLG
SCHEMBL9907995 0.86 HTR5A (0.54) HTR5APLAUPLGLMNAMAPK1
SCHEMBL9908035 0.85 HTR5A (0.76) HTR5APLAUPLG
SCHEMBL9907658 0.84 HTR5A (0.71) HTR5APLAU
SCHEMBL9907511 0.84 HTR5A (0.58) HTR5APLAUPLG
SCHEMBL9909268 0.83 HTR5A (0.61) HTR5APLAUPLGLMNAMAPK1
SCHEMBL9909316 0.83 PLG (0.48) HTR5APLAUPLGLMNAMAPK1
SCHEMBL9909315 0.81 HTR5A (0.50) HTR5APLAUPLGHTTCTSA
SCHEMBL9909177 0.80 PLAU (0.47) HTR5APLAUPLGKDM4E

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 1/4885PLAU 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.