SCHEMBL9908004

SCHEMBL9908004

O=C(O)c1ccc2c(F)cnc(-c3ccc(Cl)cc3O)c2c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 9/20 0.51
SRD5A1 P18405 1/20 0.42
SRD5A2 P31213 1/20 0.42
MAPT P10636 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
KMO O15229 2/20 0.40
MAP2K4 P45985 1/20 0.40
TTR P02766 3/20 0.39
CSNK2A2 P19784 2/20 0.38
CSNK2B P67870 2/20 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
SCHEMBL9907521 0.91 HTR5A (0.52) HTR5ASRD5A1SRD5A2MAPTMRGPRX4
SCHEMBL9907696 0.90 HTR5A (0.59) HTR5ASRD5A1SRD5A2MAPTMRGPRX4
SCHEMBL9907763 0.88 HTR5A (0.49) HTR5ASRD5A1SRD5A2MAPTMRGPRX4
SCHEMBL9907771 0.87 HTR5A (0.56) HTR5AMAP2K4TTRCSNK2A2CSNK2B
SCHEMBL9909285 0.85 SCN9A (0.51) HTR5AMRGPRX4TTR
SCHEMBL9908042 0.84 HTR5A (0.74) HTR5A
SCHEMBL9907713 0.83 CDH1 (0.51) HTR5AMAP2K4CSNK2A2CSNK2B
SCHEMBL9907542 0.82 HTR5A (0.72) HTR5AMAP2K4
SCHEMBL9907718 0.82 HTR5A (0.59) HTR5ASRD5A1SRD5A2MRGPRX4KMO
SCHEMBL9908005 0.82 HTR5A (0.51) HTR5ACSNK2A2CSNK2B

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 1/4885SRD5A1 339/4885SRD5A2 509/4885

“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.