SCHEMBL9909276

SCHEMBL9909276

COC(=O)c1ccc2c(Cl)cnc(-c3ccc(OC)cc3Cl)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 3/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CSNK2A1 P68400 2/20 0.40
CDC7 O00311 2/20 0.39
DBF4 Q9UBU7 2/20 0.39
CCNT1 O60563 1/20 0.39
CSNK2A2 P19784 1/20 0.39
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
CSNK1A1 P48729 1/20 0.39
CSNK1D P48730 1/20 0.39
CDK9 P50750 1/20 0.39
CSNK2B P67870 1/20 0.39
SCN9A Q15858 1/20 0.39
NEK1 Q96PY6 1/20 0.39
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
KMT2A Q03164 1/20 0.39
NPBWR1 P48145 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
SCHEMBL9908001 0.90 HTR5A (0.53) HTR5ACA1CA2CSNK2A1CDC7
SCHEMBL9907994 0.90 HTR5A (0.53) HTR5ACA1CA2CSNK2A1NEK1
SCHEMBL9909177 0.89 PLAU (0.47) HTR5ACA1CA2CSNK2A1CDC7
SCHEMBL9907730 0.88 MAP2K4 (0.46) HTR5ACSNK2A1CSNK2A2CSNK2BNPC1
SCHEMBL9907679 0.87 HTR5A (0.44) HTR5ACSNK2A1CSNK2A2CSNK2BSCN9A
SCHEMBL9907683 0.86 HTR5A (0.56) HTR5ACSNK2A1CDC7DBF4CSNK2A2
SCHEMBL9907661 0.84 HTR5A (0.52) HTR5ACSNK2A1KMT2AKDM4EL3MBTL1
SCHEMBL9909304 0.84 HTR5A (0.65) HTR5ACSNK2A1CDC7DBF4CCNT1
SCHEMBL9909289 0.83 MEN1 (0.45) HTR5ACSNK2A2CSNK2BSCN9APLG
SCHEMBL9907669 0.82 CSNK2A2 (0.47) HTR5ACSNK2A1CSNK2A2CSNK2BNEK1

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 2 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

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 1/4885CA1 3584/4885CA2 4025/4885

“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.