SCHEMBL17168992

SCHEMBL17168992

CCOC(=O)/C=C(\N)Cc1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 8/20 0.42
CDC7 O00311 4/20 0.40
DBF4 Q9UBU7 4/20 0.40
NAMPT P43490 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL8949906 0.84 MAPT (0.47) NPSR1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL8949899 0.84 MAPT (0.47) NPSR1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL17204516 0.83 NAPRT (0.49) CYP19A1NPSR1GAAKMT2AALDH1A1
SCHEMBL30172789 0.83 NAPRT (0.49) CYP19A1NPSR1GAAKMT2AALDH1A1
SCHEMBL17204517 0.83 NAPRT (0.49) CYP19A1NPSR1GAAKMT2AALDH1A1
SCHEMBL5643255 0.82 TDP1 (0.45) NPSR1GAAKMT2AALDH1A1HPGD
SCHEMBL8694090 0.82 MEN1 (0.44) NPSR1KMT2ALMNAMAPTL3MBTL1
SCHEMBL8694091 0.82 MEN1 (0.44) NPSR1KMT2ALMNAMAPTL3MBTL1
SCHEMBL2891426 0.78 KMT2A (0.44) CDC7DBF4NAMPTNPSR1KMT2A
SCHEMBL2891423 0.78 KMT2A (0.44) CDC7DBF4NAMPTNPSR1KMT2A

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
US-9546138-B2 Pyridone derivatives and uses thereof in the treatment of tuberculosis NOVARTIS AG (CH) 2017-01-17 US disclosed
US-9546138-B2 Pyridone derivatives and uses thereof in the treatment of tuberculosis NOVARTIS AG (CH) 2017-01-17 US disclosed
EP-2931716-B1 PYRIDONE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF TUBERCULOSIS NOVARTIS AG (CH) 2016-11-02 EP disclosed
US-20150291526-A1 PYRIDONE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF TUBERCULOSIS NOVARTIS AG (CH) 2015-10-15 US disclosed
US-20150291526-A1 PYRIDONE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF TUBERCULOSIS NOVARTIS AG (CH) 2015-10-15 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-20150291526-A1 PYRIDONE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF TUBERCULOSIS COASY, PLPBP, ACSS2 CYP19A1 488/4885CDC7 3238/4885DBF4 2582/4885

“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.