SCHEMBL2895375

SCHEMBL2895375

[c]1cnc(-c2ncccn2)s1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 13/20 0.34
CLK4 Q9HAZ1 1/20 0.31

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
SCHEMBL15398809 0.67 CYP19A1 (0.32) CYP19A1
SCHEMBL171853 0.64 HDAC8 (0.47) CLK4
SCHEMBL3596326 0.62 CYP2A6 (0.35) CYP19A1CLK4
SCHEMBL13801157 0.62 CYP19A1 (0.39) CYP19A1
SCHEMBL556950 0.62 PDPK1 (0.54) CYP19A1
SCHEMBL2373403 0.61 HDAC8 (0.33) CLK4
Hydrochloric Acid SCHEMBL6534749 0.61 HDAC8 (0.44) CLK4
SCHEMBL29810143 0.61 HDAC8 (0.44) CLK4
SCHEMBL17144230 0.61 HDAC8 (0.44) CLK4
SCHEMBL28383937 0.61 HDAC8 (0.44) CLK4

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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
EP-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 EP disclosed
US-20030162967-A1 Novel N-guanidinoalkylamides, their preparation, their use, and pharmaceutical preparations comprising them AVENTIS PHARMA DEUTSCHLAND GMBH 2003-08-28 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 (2 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-20030162967-A1 Novel N-guanidinoalkylamides, their preparation, their use, and pharmaceutical preparations comprising them F7, GUCY1A2, F9 CYP19A1 1627/4885CLK4 2701/4885
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR CYP19A1 726/4885CLK4 3547/4885

“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.