SCHEMBL9909261

SCHEMBL9909261

N#Cc1ccccc1-c1nccc2ccc(C(=O)N=C(N)N)cc12

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 6/20 0.49
F10 P00742 1/20 0.44
HTR2B P41595 9/20 0.43
HTR7 P34969 8/20 0.43
PLAU P00749 1/20 0.41
DRD2 P14416 1/20 0.41
ADRA1D P25100 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
SLC9A1 P19634 1/20 0.41
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 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
SCHEMBL9909260 0.86 HTR2B (0.44) HTR5AHTR2BHTR7PLAU
SCHEMBL16502809 0.84 HTR5A (0.53) HTR5AHTR2BHTR7PLAUDRD2
SCHEMBL9909158 0.84 KMT2A (0.46) F10PLAUKDM4EMAPTMAPK1
SCHEMBL16509476 0.84 HTR5A (0.43) HTR5AHTR2BHTR7DRD2ADRA1D
SCHEMBL7915993 0.83 SLC9A1 (0.48) HTR5AHTR2BHTR7DRD2ADRA1D
SCHEMBL9909296 0.81 HTR5A (0.45) HTR5AF10HTR2BHTR7PLAU
SCHEMBL9907915 0.80 HTR5A (0.49) HTR5AHTR2BHTR7PLAUDRD2
SCHEMBL9907904 0.80 PLAU (0.50) HTR5AHTR2BHTR7PLAUSLC9A1
SCHEMBL9909306 0.80 HTR5A (0.51) HTR5APLAU
SCHEMBL9909154 0.80 F10 (0.48) F10KDM4EMAPTMAPK1KMT2A

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 HTR5A 1/4885F10 3783/4885HTR2B 6/4885

“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.