SCHEMBL2900645

SCHEMBL2900645

Clc1cccnc1-c1n[c]cs1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.35
CYP19A1 P11511 1/20 0.33
CNR2 P34972 1/20 0.33
S100A4 P26447 1/20 0.33
CDC25B P30305 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
RORB Q92753 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
SCHEMBL2900498 0.76
SCHEMBL2753759 0.74 TRPM8 (0.31) SMN1; SMN2
SCHEMBL577973 0.73 ALDH1A1 (0.46) CYP19A1SMN1; SMN2
SCHEMBL2894881 0.72 CNR2 (0.33) CNR2SMN1; SMN2
SCHEMBL2897576 0.72 KDM4E (0.38) SMN1; SMN2
SCHEMBL2306238 0.72 DPP4 (0.48) DPP4CNR2S100A4CDC25BRORB
SCHEMBL2897942 0.70 DPP4 (0.36) DPP4CYP19A1CNR2S100A4CDC25B
SCHEMBL2752330 0.70 HTR2C (0.39)
SCHEMBL8688609 0.70 DPP4 (0.47) DPP4CNR2S100A4CDC25BRORB
SCHEMBL4633189 0.70 DPP4 (0.47) DPP4CNR2S100A4CDC25BRORB

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 DPP4 683/4885CYP19A1 726/4885CNR2 1254/4885

“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.