SCHEMBL9907375

SCHEMBL9907375

O=C(O)c1ccc2ccnc(-c3ccc(Cl)cc3F)c2c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.53
PLAU P00749 1/20 0.46
KDM4C Q9H3R0 3/20 0.42
KDM5B Q9UGL1 2/20 0.42
KDM5A P29375 1/20 0.42
GRM2 Q14416 1/20 0.42
SRD5A1 P18405 1/20 0.42
SRD5A2 P31213 1/20 0.42
RORC P51449 6/20 0.41
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
MRGPRX4 Q96LA9 2/20 0.40
TTR P02766 1/20 0.39
CDH1 P12830 1/20 0.39
APC P25054 1/20 0.39
CTNNB1 P35222 1/20 0.39
TCF7L2 Q9NQB0 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
SCHEMBL9907383 0.87 KDM4C (0.49) KMOPLAUKDM4CKDM5BSRD5A1
SCHEMBL9907366 0.86 KMO (0.44) KMOPLAUKDM4CRORCCSNK2A2
SCHEMBL9907912 0.84 HTR5A (0.59) KMOPLAU
SCHEMBL9909159 0.82 PLAU (0.43) KMOPLAUKDM4CKDM5BSRD5A1
SCHEMBL9909227 0.82 SLC22A12 (0.47) PLAUKDM4CKDM5BKDM5ARORC
SCHEMBL9907395 0.82 PLAU (0.43) KMOPLAUKDM4CKDM5BSRD5A1
SCHEMBL9907436 0.82 PLAU (0.43) KMOPLAUKDM4CKDM5BKDM5A
SCHEMBL9907521 0.81 HTR5A (0.52) KMOSRD5A1SRD5A2MRGPRX4TTR
SCHEMBL9907718 0.80 HTR5A (0.59) KMOPLAUKDM4CSRD5A1SRD5A2
SCHEMBL9907352 0.79 KMO (0.51) KMOKDM4CKDM5BKDM5AGRM2

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 5 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
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 KMO 559/4885PLAU 3322/4885KDM4C 1366/4885

“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.