SCHEMBL9909209

SCHEMBL9909209

COc1ccccc1-c1ccnc2ccc(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
SLC9A1 P19634 4/20 0.47
CHUK O15111 1/20 0.46
INSR P06213 1/20 0.46
MAPK8 P45983 1/20 0.46
CAMKK2 Q96RR4 1/20 0.46
HTR7 P34969 6/20 0.43
HTR2B P41595 6/20 0.43
GCGR P47871 1/20 0.42
DRD2 P14416 1/20 0.42
ADRA1D P25100 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
FYN P06241 1/20 0.41

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
SCHEMBL9907817 0.85 HTR5A (0.53) HTR5ASLC9A1HTR7HTR2BDRD2
SCHEMBL9909213 0.83 KDM4C (0.46) CHUKINSRMAPK8CAMKK2GCGR
SCHEMBL9909299 0.83 SCN9A (0.45) HTR5A
SCHEMBL9909202 0.82 HTT (0.51) CHUKINSRMAPK8CAMKK2GCGR
SCHEMBL9907787 0.81 PIK3CA (0.49) HTR5ASLC9A1HTR7HTR2BDRD2
SCHEMBL9907794 0.80 HTR5A (0.45) HTR5AHTR7HTR2BDRD2ADRA1D
SCHEMBL9909296 0.80 HTR5A (0.45) HTR5ASLC9A1HTR7HTR2BDRD2
SCHEMBL9907810 0.79 HTR5A (0.53) HTR5ASLC9A1HTR7HTR2B
SCHEMBL9907792 0.79 HTR5A (0.51) HTR5ASLC9A1HTR7HTR2B
SCHEMBL9909225 0.78 HTR5A (0.57) HTR5A

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 1/4885SLC9A1 1181/4885CHUK 2224/4885

“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.