SCHEMBL10030467

SCHEMBL10030467

N#Cc1cc(F)c(-c2ccncc2)c2cc(C(=O)N=C(N)N)ccc12

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 18/20 0.48
HIPK2 Q9H2X6 1/20 0.38

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
SCHEMBL10030441 0.85 HIPK2 (0.41) HIPK2
SCHEMBL614953 0.84 HTR5A (0.55) HTR5A
SCHEMBL10030440 0.81 DYRK1A (0.39) HIPK2
SCHEMBL9907919 0.76 HTR5A (0.72) HTR5A
SCHEMBL10064210 0.74 HTR5A (0.47) HTR5AHIPK2
SCHEMBL616461 0.73 HTR5A (0.56) HTR5A
SCHEMBL614952 0.73 HTR5A (0.55) HTR5A
SCHEMBL7909269 0.73 HTR5A (0.45) HTR5A
SCHEMBL10064301 0.73 HTR5A (0.43) HTR5A
SCHEMBL16502802 0.71 HTR5A (0.46) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120041036-A1 SUBSTITUTED ACYLGUANIDINE DERIVATIVES (AS AMENDED) ASTELLAS PHARMA INC. (JP) 2012-02-16 US disclosed
US-20120041036-A1 SUBSTITUTED ACYLGUANIDINE DERIVATIVES (AS AMENDED) ASTELLAS PHARMA INC. (JP) 2012-02-16 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-20120041036-A1 SUBSTITUTED ACYLGUANIDINE DERIVATIVES (AS AMENDED) HTR5A, HTR2A, HTR1A HTR5A 1/4885HIPK2 2763/4885

“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.