SCHEMBL48972

SCHEMBL48972

O=C1C=CC(=O)c2c1c2=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 3/20 0.47
AURKA O14965 2/20 0.47
AURKB Q96GD4 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP1A1 P04798 1/20 0.47
TXNRD1 Q16881 1/20 0.47
TXNRD3 Q86VQ6 1/20 0.47
COPS5 Q92905 1/20 0.47
TXNRD2 Q9NNW7 1/20 0.47
ALDH1A1 P00352 6/20 0.45
MAPT P10636 5/20 0.45
MEN1 O00255 5/20 0.45
HPGD P15428 5/20 0.45
KMT2A Q03164 5/20 0.45
HSD17B10 Q99714 4/20 0.45
MAPK1 P28482 4/20 0.45
LMNA P02545 4/20 0.45
THRB P10828 3/20 0.45
ALOX15 P16050 3/20 0.45
BLM P54132 3/20 0.45

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
SCHEMBL30029972 0.67 CDC25B (0.48) CDC25BAURKAAURKBCYP1A2CYP1A1
SCHEMBL17490272 0.67 CDC25B (0.41) CDC25BAURKAAURKBCYP1A2CYP1A1
SCHEMBL9902097 0.67 ALDH1A1 (0.60) CDC25BAURKAAURKBCYP1A2CYP1A1
SCHEMBL14253089 0.67 CDC25B (0.48) CDC25BAURKAAURKBCYP1A2CYP1A1
SCHEMBL8663747 0.65 MEN1 (0.50) CDC25BAURKAAURKBCYP1A2CYP1A1
Naphthazalin SCHEMBL149279 0.65 TXNRD1 (1.00) CDC25BAURKAAURKBCYP1A2CYP1A1
Naphthazalin SCHEMBL29353283 0.65 TXNRD1 (1.00) CDC25BAURKAAURKBCYP1A2CYP1A1
SCHEMBL10716852 0.65 THRB (0.58) CDC25BAURKAAURKBCYP1A2CYP1A1
Naphthazalin SCHEMBL21403377 0.63 TXNRD1 (0.94) CDC25BAURKAAURKBCYP1A2CYP1A1
SCHEMBL13907269 0.63 HPGD (1.00) CDC25BAURKAAURKBCYP1A2CYP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8128970-B2 Sesame seed derived pigments OMNICA GMBH (DE) 2012-03-06 US claimed
CN-107528066-B Water-based zinc ion battery based on carbonyl compound cathode material and preparation method thereof 南开大学 2020-10-02 CN disclosed
US-8128970-B2 Sesame seed derived pigments OMNICA GMBH (DE) 2012-03-06 US disclosed
EP-2323501-A2 REDUCED SESAME SEED DERIVED PIGMENTS OMNICA GMBH (DE) 2011-05-25 EP disclosed
CN-101656317-A Constituents and methods for protecting fuel cell components, including pems GEN MOTORS CORP 2010-02-24 CN disclosed
WO-2010012751-A2 SESAME SEED DERIVED PIGMENTS OMNICA GMBH (DE) 2010-02-04 WO disclosed
US-20100028474-A1 SESAME SEED DERIVED PIGMENTS OMNICA GMBH (DE) 2010-02-04 US disclosed
CN-100555720-C Compositions and methods for protecting fuel cell components containing PEMs GEN MOTORS CORP (US) 2009-10-28 CN disclosed
US-7220509-B2 Constituents and methods for protecting fuel cell components, including PEMs GENERAL MOTORS CORPORATION (US) 2007-05-22 US disclosed
WO-2006026031-A2 CONSTITUENTS AND METHODS FOR PROTECTING FUEL CELL COMPONENTS, INCLUDING PEMS GENERAL MOTORS CORPORATION (US) 2006-03-09 WO disclosed
US-20060046120-A1 Constituents and methods for protecting fuel cell components, including PEMS GM Global Technology Operations LLC 2006-03-02 US 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-20100028474-A1 SESAME SEED DERIVED PIGMENTS TYR, HCCS, NQO1 CDC25B 3153/4885AURKA 3048/4885AURKB 3309/4885

“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.