SCHEMBL9909286

SCHEMBL9909286

COC(=O)c1ccc2c(Cl)cnc(-c3ccc(F)cc3OC)c2c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 3/20 0.53
SCN9A Q15858 8/20 0.46
SCN5A Q14524 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
KCNQ3 O43525 1/20 0.43
KCNQ2 O43526 1/20 0.43
MAP2K4 P45985 1/20 0.42
ROCK2 O75116 2/20 0.42
ROCK1 Q13464 2/20 0.42
KDM4E B2RXH2 1/20 0.41
CCNT1 O60563 1/20 0.41
CDK9 P50750 1/20 0.41
PARP1 P09874 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
SCHEMBL9909311 0.91 HTR5A (0.51) HTR5ASCN9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL9909194 0.90 HTR5A (0.54) HTR5ASCN9ASCN5AKCNQ3KCNQ2
SCHEMBL9907683 0.90 HTR5A (0.56) HTR5ASCN9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL9909277 0.89 SCN9A (0.50) HTR5ASCN9ASCN5AKCNQ3KCNQ2
SCHEMBL9909289 0.89 MEN1 (0.45) HTR5ASCN9ASMN1; SMN2MAP2K4ROCK2
SCHEMBL9907731 0.89 HTR5A (0.67) HTR5ASMN1; SMN2MAP2K4PARP1
SCHEMBL9907675 0.88 HTR5A (0.54) HTR5ASCN9ASMN1; SMN2HPGDMAP2K4
SCHEMBL9907745 0.87 HTR5A (0.55) HTR5ASMN1; SMN2HPGDMAP2K4KDM4E
SCHEMBL9908003 0.86 HTR5A (0.52) HTR5ASMN1; SMN2HPGDKCNQ3KCNQ2
SCHEMBL9909258 0.85 HTR5A (0.76) 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 1/4885SCN9A 412/4885SCN5A 58/4885

“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.