SCHEMBL9907688

SCHEMBL9907688

O=C(O)c1ccc2c(Cl)cnc(-c3ccc(F)cc3Cl)c2c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 7/20 0.60
PLAU P00749 3/20 0.42
MAP2K4 P45985 2/20 0.40
MAPK1 P28482 1/20 0.40
MAPK6 Q16659 1/20 0.40
PLG P00747 1/20 0.40
MAP4K4 O95819 1/20 0.40
GRM2 Q14416 1/20 0.39
NAPRT Q6XQN6 1/20 0.39
PYGL P06737 1/20 0.39
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
AURKA O14965 1/20 0.38
TSHR P16473 1/20 0.37

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
SCHEMBL9907733 0.91 HTR5A (0.72) HTR5APLAU
SCHEMBL9907542 0.91 HTR5A (0.72) HTR5AMAP2K4MAPK1MAPK6MAP4K4
SCHEMBL9907678 0.89 HTR5A (0.57) HTR5APLAUMAP2K4MAPK1MAPK6
SCHEMBL9907750 0.89 HTR5A (0.59) HTR5APLAUMAP2K4MAPK1MAPK6
SCHEMBL9907732 0.87 SRD5A2 (0.49) HTR5APLAUMAP2K4PLG
SCHEMBL9908017 0.86 HTR5A (0.54) HTR5APLAUMAP2K4MAPK1MAPK6
SCHEMBL9909194 0.86 HTR5A (0.54) HTR5APLAUMAPK1PLGPYGL
SCHEMBL9907683 0.85 HTR5A (0.56) HTR5AMAP2K4CSNK2A2CSNK2B
SCHEMBL9907685 0.85 HTR5A (0.47) HTR5APLAUMAP2K4MAPK1MAPK6
SCHEMBL9907996 0.84 HTR5A (0.51) HTR5APLAUMAP2K4MAPK1MAPK6

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 HTR5A 1/4885PLAU 3322/4885MAP2K4 3941/4885

“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.