SCHEMBL2895231

SCHEMBL2895231

Cc1[c]cnn1-c1c(Cl)cccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
MAPK14 Q16539 7/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PAX8 Q06710 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
NOTUM Q6P988 1/20 0.32
HSD11B1 P28845 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HCAR1 Q9BXC0 1/20 0.31
KCNJ5 P48544 1/20 0.30

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
SCHEMBL1906555 0.81 ALDH1A1 (0.38) MEN1KMT2ANPSR1ALDH1A1HCAR1
SCHEMBL15554016 0.81 MAPK14 (0.33) MAPK14ALDH1A1
SCHEMBL1903586 0.80 MAPK14 (0.40) CDK4CCND1MAPK14MEN1KMT2A
SCHEMBL2900617 0.76 CYP17A1 (0.42) HSD11B1
SCHEMBL2900512 0.75 LIMK1 (0.32)
SCHEMBL1902318 0.74 NPC1 (0.46) HPGDKMT2ASMN1; SMN2NPSR1NPC1
SCHEMBL2897719 0.74 CHRM5 (0.34) MEN1HPGDKMT2ASMN1; SMN2NPC1
SCHEMBL2894927 0.74 LIMK1 (0.31)
SCHEMBL2903331 0.74
SCHEMBL2347651 0.72 NPC1 (0.42) MEN1KMT2ASMN1; SMN2NPC1RAB9A

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-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

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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR CDK4 2916/4885CCND1 185/4885MAPK14 4228/4885

“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.