SCHEMBL264757

SCHEMBL264757

O=c1[nH]n(-c2ccccc2)c(=O)n1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 3/20 0.54
GSK3B P49841 3/20 0.54
GAA P10253 2/20 0.54
TSHR P16473 1/20 0.50
MPI P34949 1/20 0.50
NTRK1 P04629 1/20 0.47
IGF1R P08069 1/20 0.47
FGFR1 P11362 1/20 0.47
NTRK3 Q16288 1/20 0.47
NTRK2 Q16620 1/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
MAPK1 P28482 1/20 0.47
ALOX15 P16050 1/20 0.44
PGR P06401 1/20 0.44
HTT P42858 1/20 0.43
MAPT P10636 1/20 0.42
AURKA O14965 1/20 0.42
DAPK3 O43293 1/20 0.42
PDGFRA P16234 1/20 0.42

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
SCHEMBL23895082 0.96 GSK3A (0.50) GSK3AGSK3BGAATSHRMPI
SCHEMBL2041567 0.89 GAA (0.44) GSK3AGSK3BGAATSHRMPI
SCHEMBL11613205 0.86 MEN1 (0.47) GSK3AGSK3BGAATSHRMPI
SCHEMBL2043266 0.81 AURKA (0.46) GSK3AGSK3BGAANTRK1IGF1R
SCHEMBL2045853 0.79 GAA (0.41) GSK3AGSK3BGAANTRK1IGF1R
SCHEMBL2042298 0.78 NTRK1 (0.45) GSK3AGSK3BGAANTRK1IGF1R
SCHEMBL2045688 0.78 TP53 (0.40) GSK3AGSK3BGAANTRK1IGF1R
SCHEMBL3909707 0.78 GSK3A (0.52) GSK3AGSK3BGAATSHRMPI
SCHEMBL264035 0.78 GSK3A (0.45) GSK3AGSK3BGAATSHRMPI
SCHEMBL5326615 0.78 GSK3A (0.55) GSK3AGSK3BGAATSHRMPI

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1655070-B1 OXIDATION CATALYST ASAHI KASEI CHEMICALS CORP (JP) 2015-07-15 EP disclosed
US-8133834-B2 Oxidation catalyst ASAHI KASEI CHEMICALS CORPORATION (JP) 2012-03-13 US disclosed
US-20100069670-A1 Oxidation catalyst ASAHI KASEI CHEMICALS CORPORATION (JP) 2010-03-18 US disclosed
US-20060229471-A1 Oxidation catalyst ASAHI KASEI CHEMICALS CORPORATION (JP) 2006-10-12 US disclosed
EP-1655070-A1 OXIDATION CATALYST Asahi Kasei Chemicals Corporation (JP) 2006-05-10 EP disclosed
EP-0390026-A2 Urazol derivatives as initiators for radical polymerization BASF Aktiengesellschaft (DE) 1990-10-03 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 (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-20100069670-A1 Oxidation catalyst PPOX, SOD1, HAO2 GSK3A 4315/4885GSK3B 4503/4885GAA 2093/4885
US-20060229471-A1 Oxidation catalyst PPOX, SOD1, HAO2 GSK3A 4315/4885GSK3B 4503/4885GAA 2093/4885

“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.