SCHEMBL20945151

SCHEMBL20945151

COC(=O)c1ccc(NN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
ALOX15 P16050 1/20 0.59
HTT P42858 1/20 0.59
CYP1A2 P05177 1/20 0.59
POLB P06746 2/20 0.53
CDC25B P30305 3/20 0.52
CDC25A P30304 2/20 0.52
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CYP19A1 P11511 1/20 0.48
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
ALDH1A1 P00352 2/20 0.47

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
SCHEMBL27398601 0.85 MEN1 (0.62) MAPK1SMN1; SMN2HTTCYP1A2MEN1
SCHEMBL27386759 0.85 CYP1A2 (0.53) MAPK1SMN1; SMN2ALOX15HTTCYP1A2
SCHEMBL27389198 0.84 HSD17B10 (0.66) MAPK1SMN1; SMN2CYP1A2POLBMEN1
SCHEMBL20945035 0.82 CYP1A2 (0.70) MAPK1HTTCYP1A2POLBCDC25B
SCHEMBL5821136 0.79 CYP1A2 (0.65) MAPK1SMN1; SMN2HTTCYP1A2POLB
SCHEMBL27570670 0.78 PLA2G1B (0.65) MAPK1SMN1; SMN2ALOX15HTTPOLB
SCHEMBL9657352 0.76 CYP1A2 (0.71) MAPK1HTTCYP1A2POLBMEN1
SCHEMBL3259551 0.75 CYP1A2 (1.00) HTTCYP1A2MEN1KMT2AL3MBTL1
SCHEMBL25430151 0.75 POLB (0.64) MAPK1SMN1; SMN2ALOX15HTTPOLB
SCHEMBL31542122 0.75 POLB (0.64) MAPK1SMN1; SMN2ALOX15HTTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109415345-B Pyridazinone-based broad-spectrum anti-influenza inhibitors 豪夫迈·罗氏有限公司 2022-01-11 CN disclosed
EP-3478671-B1 PYRIDAZINONE-BASED BROAD SPECTRUM ANTI-INFLUENZA INHIBITORS HOFFMANN LA ROCHE (CH) 2020-05-13 EP disclosed
US-10597380-B2 Pyridazinone-based broad spectrum anti-influenza inhibitors HOFFMANN-LA ROCHE INC. (US) 2020-03-24 US disclosed
US-20190127349-A1 PYRIDAZINONE-BASED BROAD SPECTRUM ANTI-INFLUENZA INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2019-05-02 US disclosed
CN-1067052-A The diaminophthalimides and the analogue thereof that replace CIBA GEIGY AG (CH) 1992-12-16 CN 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-20190127349-A1 PYRIDAZINONE-BASED BROAD SPECTRUM ANTI-INFLUENZA INHIBITORS ABCG2, PIR, PRNP MAPK1 1411/4885SMN1; SMN2 4559/4885ALOX15 3534/4885
US-10597380-B2 Pyridazinone-based broad spectrum anti-influenza inhibitors ABCG2, PIR, PRNP MAPK1 1411/4885SMN1; SMN2 4559/4885ALOX15 3534/4885

“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.