SCHEMBL9909311

SCHEMBL9909311

COC(=O)c1ccc2c(Cl)cnc(-c3cc(F)ccc3OC)c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 4/20 0.51
DHODH Q02127 1/20 0.44
PLG P00747 1/20 0.44
PLAU P00749 1/20 0.44
KCNQ3 O43525 1/20 0.43
KCNQ2 O43526 1/20 0.43
MAP2K4 P45985 1/20 0.42
SCN9A Q15858 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC6 Q9UBN7 2/20 0.41
KDM1A O60341 1/20 0.41
HDAC1 Q13547 1/20 0.41
CTSA P10619 1/20 0.41
PARP1 P09874 1/20 0.41
CCNT1 O60563 2/20 0.40
CDK9 P50750 2/20 0.40
GLA P06280 1/20 0.40
KMT2A Q03164 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
SCHEMBL9909286 0.91 HTR5A (0.53) HTR5AKCNQ3KCNQ2MAP2K4SCN9A
SCHEMBL9909295 0.90 PLG (0.54) HTR5ADHODHPLGPLAUKCNQ3
SCHEMBL9907745 0.89 HTR5A (0.55) HTR5AMAP2K4HPGDSMN1; SMN2PARP1
SCHEMBL9908003 0.88 HTR5A (0.52) HTR5AKCNQ3KCNQ2MAP2K4HPGD
SCHEMBL9907683 0.88 HTR5A (0.56) HTR5AMAP2K4SCN9AALDH1A1HPGD
SCHEMBL9907731 0.87 HTR5A (0.67) HTR5AMAP2K4SMN1; SMN2PARP1
SCHEMBL9907675 0.86 HTR5A (0.54) HTR5AMAP2K4SCN9AHPGDSMN1; SMN2
SCHEMBL9909319 0.85 HTR5A (0.73) HTR5APLGPLAU
SCHEMBL9925468 0.84 HTR5A (0.56) HTR5ADHODHPLGPLAUKCNQ3
SCHEMBL9908022 0.83 MAP2K4 (0.52) HTR5AMAP2K4ALDH1A1HPGDPARP1

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
EP-2463276-B1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC (JP) 2014-03-12 EP disclosed
US-20120142727-A1 NITROGENOUS-RING ACYLGUANIDINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-07 US 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 1/4885DHODH 3018/4885PLG 3328/4885

“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.