SCHEMBL9907756

SCHEMBL9907756

O=C(O)c1ccc2c(Cl)cnc(-c3cccc(Cl)c3F)c2c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 7/20 0.50
KMO O15229 2/20 0.47
PLAU P00749 3/20 0.44
MRGPRX4 Q96LA9 1/20 0.43
RORC P51449 2/20 0.41
CSNK2A1 P68400 1/20 0.41
SLC22A12 Q96S37 1/20 0.40
MAP4K4 O95819 1/20 0.39
PLG P00747 1/20 0.39
TTR P02766 2/20 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
SCHEMBL9907735 0.91 HTR5A (0.59) HTR5AKMOMRGPRX4RORCCSNK2A1
SCHEMBL9907729 0.91 HTR5A (0.55) HTR5AKMOPLAURORCPLG
SCHEMBL9908016 0.89 HTR5A (0.47) HTR5APLAUMRGPRX4RORCSLC22A12
SCHEMBL9907728 0.87 HTR5A (0.46) HTR5APLAUMRGPRX4SLC22A12MAP4K4
SCHEMBL9907662 0.87 HTR5A (0.56) HTR5APLAUCSNK2A1SLC22A12MAP4K4
SCHEMBL9907681 0.86 HTR5A (0.56) HTR5APLAURORCMAP4K4PLG
SCHEMBL9907991 0.86 HTR5A (0.46) HTR5APLAUSLC22A12MAP4K4PLG
SCHEMBL9907751 0.86 HTR5A (0.47) HTR5AKMORORCCSNK2A1
SCHEMBL9907993 0.85 HTR5A (0.54) HTR5APLAURORCPLG
SCHEMBL9908002 0.85 HTR5A (0.45) HTR5APLAUMRGPRX4RORCSLC22A12

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 1/4885KMO 559/4885PLAU 3322/4885

“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.