SCHEMBL8649103

SCHEMBL8649103

COC(=O)Cn1cccc(N)c1=O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.51
KDM4E B2RXH2 6/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 4/20 0.43
GAA P10253 2/20 0.41
KMT2A Q03164 1/20 0.40
HPGD P15428 1/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
Hydrochloric Acid SCHEMBL20944983 0.98 ELANE (0.50) ELANEKDM4ESMN1; SMN2ALDH1A1GAA
SCHEMBL3911656 0.84 ALDH1A1 (0.50) ELANEKDM4ESMN1; SMN2ALDH1A1
SCHEMBL20945137 0.84 PARP1 (0.49) ELANEKDM4ESMN1; SMN2ALDH1A1GAA
SCHEMBL20338824 0.84 ELANE (0.44) ELANEKDM4ESMN1; SMN2ALDH1A1KMT2A
SCHEMBL5116947 0.83 ELANE (0.48) ELANEKDM4EALDH1A1KMT2APOLB
SCHEMBL20338823 0.83 ELANE (0.48) ELANEKDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL9609770 0.82 KDM4E (0.50) KDM4ESMN1; SMN2ALDH1A1GAAKMT2A
SCHEMBL8102665 0.82 KDM4E (0.50) KDM4ESMN1; SMN2ALDH1A1GAAL3MBTL1
SCHEMBL20945159 0.82 TNF (0.45) ELANEKDM4EALDH1A1L3MBTL1
SCHEMBL21486645 0.81 ELANE (0.52) ELANEKDM4ESMN1; SMN2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1179151-A Lactam-containing hydroxamic acid derivatives, process for their preparation and their use as inhibitors of matrix metalloproteinases PROCTER & GAMBLE (US) 1998-04-15 CN claimed
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-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
US-20190127349-A1 PYRIDAZINONE-BASED BROAD SPECTRUM ANTI-INFLUENZA INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2019-05-02 US disclosed
CN-1192035-C Inhibitors of interleukin-1'beta' converting enzyme VERTEX PHARMA (US) 2005-03-09 CN disclosed
US-5847135-A Inhibitors of interleukin-1β converting enzyme VERTEX PHARMACEUTICALS, INCORPORATED (US) 1998-12-08 US disclosed
CN-1179151-A Lactam-containing hydroxamic acid derivatives, process for their preparation and their use as inhibitors of matrix metalloproteinases PROCTER & GAMBLE (US) 1998-04-15 CN disclosed
US-5716929-A THERAPY FOR INFLAMMATION, AUTOIMMUNE DISEASES VERTEX PHARMACEUTICALS, INC. (US) 1998-02-10 US disclosed
CN-1159196-A Inhibitors of interleukin-1'beta' converting enzyme VERTEX PHARMA (US) 1997-09-10 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 ELANE 2561/4885KDM4E 1753/4885SMN1; SMN2 4559/4885
US-10597380-B2 Pyridazinone-based broad spectrum anti-influenza inhibitors ABCG2, PIR, PRNP ELANE 2561/4885KDM4E 1753/4885SMN1; SMN2 4559/4885

“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.