SCHEMBL9909200

SCHEMBL9909200

COc1cc(Cl)ccc1-c1ncc(Cl)c2ccc(C(=O)O)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.51
PLG P00747 1/20 0.51
TTR P02766 1/20 0.48
MRGPRX4 Q96LA9 2/20 0.44
HTR5A P47898 1/20 0.43
LRRK2 Q5S007 1/20 0.42
SCN9A Q15858 7/20 0.42
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
ALOX15 P16050 1/20 0.41
CYP2C19 P33261 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40

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
SCHEMBL9909289 0.90 MEN1 (0.45) PLAUPLGHTR5ASCN9ANPC1
SCHEMBL9909285 0.89 SCN9A (0.51) PLAUPLGTTRMRGPRX4HTR5A
SCHEMBL9909194 0.89 HTR5A (0.54) PLAUPLGHTR5ALRRK2SCN9A
SCHEMBL9909283 0.86 PLAU (0.49) PLAUPLGMRGPRX4HTR5ALRRK2
SCHEMBL9907732 0.85 SRD5A2 (0.49) PLAUPLGTTRHTR5ANPC1
SCHEMBL9909292 0.85 HTR5A (0.64) PLAUPLGHTR5A
SCHEMBL9907708 0.84 KDM4C (0.47) PLAUPLGTTRMRGPRX4HTR5A
SCHEMBL9909177 0.82 PLAU (0.47) PLAUPLGMRGPRX4HTR5ACA1
SCHEMBL9907718 0.82 HTR5A (0.59) PLAUMRGPRX4HTR5AKDM4CSRD5A1
SCHEMBL9909295 0.82 PLG (0.54) PLAUPLGTTRHTR5ALRRK2

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 3 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-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 PLAU 3322/4885PLG 3328/4885TTR 3634/4885

“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.