SCHEMBL9540945

SCHEMBL9540945

O=c1cnn(CO)c(=O)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.56
GRIA2 P42262 1/20 0.56
GRIA4 P48058 1/20 0.56
GRIK5 Q16478 1/20 0.56
PDE3A Q14432 2/20 0.38
THRB P10828 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
P2RX7 Q99572 3/20 0.30
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL11402130 0.76 GRIA1 (0.49) GRIA1GRIA2GRIA4GRIK5PDE3A
SCHEMBL11241808 0.75 GRIA1 (0.47) GRIA1GRIA2GRIA4GRIK5PDE3A
SCHEMBL11234127 0.75 GRIA1 (0.47) GRIA1GRIA2GRIA4GRIK5PDE3A
SCHEMBL11304991 0.73 GRIA1 (0.54) GRIA1GRIA2GRIA4GRIK5PDE3A
SCHEMBL2723681 0.73 PDE3A (0.51) GRIA1GRIA2GRIA4GRIK5PDE3A
SCHEMBL9393484 0.72 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5HIF1A
SCHEMBL9396137 0.72 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5HIF1A
SCHEMBL9393490 0.72 GRIA1 (1.00) GRIA1GRIA2GRIA4GRIK5HIF1A
SCHEMBL6268666 0.72 PDE3A (0.47) GRIA1GRIA2GRIA4GRIK5PDE3A
SCHEMBL14544299 0.71 GRIA1 (0.48) GRIA1GRIA2GRIA4GRIK5PDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993014635-A1 PRACTICAL METHOD FOR DETERMINING A CHEMICAL HYBRIDIZING AGENT-APPLICATION TIME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-05 WO claimed
US-4297129-A HERBICIDES; WILD OATS; NONPHYTOTOXIC SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-10-27 US claimed
JP-55143904-A None JP disclosed
JP-55143904-A None JP disclosed
US-20230089582-A1 1,2,4-TRIAZINE-3,5-DIONE COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF KPC PHARMACEUTICALS INC (CN) 2023-03-23 US disclosed
EP-4083024-A1 1,2,4-TRIAZINE-3,5-DIONE COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF KPC Pharmaceuticals, Inc. (CN) 2022-11-02 EP disclosed
WO-1993014635-A1 PRACTICAL METHOD FOR DETERMINING A CHEMICAL HYBRIDIZING AGENT-APPLICATION TIME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-05 WO disclosed
US-4297129-A HERBICIDES; WILD OATS; NONPHYTOTOXIC SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-10-27 US disclosed
JP-S55143904-A HERBICIDE COMPRISING 2-HYDROXYMETHYL-1,2,4-TRIAZINE-3,5-DIONE OR ITS SALT AS ACTIVE CONSTITUENT SUMITOMO CHEM CO LTD 1980-11-10 JP disclosed
JP-S55143904-A HERBICIDE COMPRISING 2-HYDROXYMETHYL-1,2,4-TRIAZINE-3,5-DIONE OR ITS SALT AS ACTIVE CONSTITUENT SUMITOMO CHEM CO LTD 1980-11-10 JP 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-20230089582-A1 1,2,4-TRIAZINE-3,5-DIONE COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF THRB, THRA, TSHR GRIA1 656/4885GRIA2 967/4885GRIA4 1563/4885

“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.