SCHEMBL2897808

SCHEMBL2897808

O=[N+]([O-])c1ccc(Oc2cc[c]cn2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 3/20 0.52
RAB9A P51151 3/20 0.50
LMNA P02545 3/20 0.50
HTT P42858 2/20 0.50
GAA P10253 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MAPT P10636 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 1/20 0.42
MAPK1 P28482 1/20 0.42
MYOC Q99972 1/20 0.42
ALDH1A1 P00352 2/20 0.41
SRD5A2 P31213 1/20 0.41
HPGD P15428 1/20 0.41
LTA4H P09960 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL4714612 0.78 HSPB1 (0.68) HSPB1RAB9ALMNAHTTGAA
SCHEMBL3045482 0.78 HSPB1 (0.63) HSPB1RAB9ALMNAHTTL3MBTL1
SCHEMBL20932230 0.77 HSPB1 (0.82) HSPB1RAB9ALMNAHTTGAA
SCHEMBL2894725 0.75 PTGS2 (0.38) LMNAHTTALDH1A1PTGS1PTGS2
SCHEMBL2901814 0.75 L3MBTL1 (0.44) RAB9ALMNAHTTGAAL3MBTL1
SCHEMBL2899323 0.75 MAPT (0.39) HTTMAPTMEN1KMT2AMAPK1
SCHEMBL2894972 0.75 MEN1 (0.52) RAB9ALMNAHTTGAAMAPT
SCHEMBL2903058 0.75 MEN1 (0.44) RAB9ALMNAHTTGAAL3MBTL1
SCHEMBL1712271 0.75 MEN1 (0.50) HSPB1HTTGAAL3MBTL1MEN1
SCHEMBL315475 0.74 ALDH1A1 (0.43) RAB9AHTTL3MBTL1MAPTMEN1

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 HSPB1 3871/4885RAB9A 1806/4885LMNA 2262/4885

“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.