SCHEMBL2894725

SCHEMBL2894725

CS(=O)(=O)c1ccc(Oc2cc[c]cn2)cc1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.38
PTGS1 P23219 4/20 0.38
SLC6A4 P31645 1/20 0.35
ENPP2 Q13822 1/20 0.35
HTT P42858 3/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HAO1 Q9UJM8 1/20 0.34
GCK P35557 1/20 0.34
GPR119 Q8TDV5 1/20 0.34

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
SCHEMBL2900856 0.84 LMNA (0.58) HTTLMNASMN1; SMN2ALDH1A1
SCHEMBL2894972 0.78 MEN1 (0.52) HTTLMNASMN1; SMN2ALDH1A1
SCHEMBL2903058 0.78 MEN1 (0.44) HTTLMNAALDH1A1HAO1
SCHEMBL2937729 0.78 HTT (0.47) PTGS2PTGS1SLC6A4ENPP2HTT
SCHEMBL2897808 0.75 HSPB1 (0.52) PTGS2PTGS1HTTLMNAALDH1A1
SCHEMBL2899323 0.75 MAPT (0.39) PTGS2HTTALDH1A1
SCHEMBL1712271 0.75 MEN1 (0.50) HTTSMN1; SMN2ALDH1A1
SCHEMBL2901814 0.75 L3MBTL1 (0.44) HTTLMNASMN1; SMN2ALDH1A1HAO1
SCHEMBL315475 0.74 ALDH1A1 (0.43) HTTSMN1; SMN2ALDH1A1HAO1
SCHEMBL2901946 0.74 RAB9A (0.54) HTTLMNASMN1; SMN2ALDH1A1

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 PTGS2 1684/4885PTGS1 1616/4885SLC6A4 2788/4885

“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.