SCHEMBL15217706

SCHEMBL15217706

O=C1CC(=O)N(c2ccccc2)c2ncccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.47
TLR9 Q9NR96 2/20 0.47
PKM P14618 1/20 0.47
HPGD P15428 2/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 7/20 0.40
HTT P42858 2/20 0.38
KDM4E B2RXH2 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HIF1A Q16665 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
CES2 O00748 1/20 0.37
BCHE P06276 1/20 0.37
CES1 P23141 1/20 0.37
HSD17B10 Q99714 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL1150422 0.81 HPGD (0.57) GAATLR9PKMHPGDMEN1
SCHEMBL15206968 0.75 KMT2A (0.68) GAATLR9PKMHPGDMEN1
SCHEMBL9980850 0.72 MEN1 (0.50) GAATLR9PKMHPGDMEN1
SCHEMBL17952759 0.71 KDM4E (0.42) GAAPKMMEN1KMT2AALDH1A1
SCHEMBL1150266 0.71 HPGD (0.57) GAATLR9PKMHPGDMEN1
SCHEMBL9348254 0.70 PGR (0.43) MEN1KMT2AALDH1A1HTTHIF1A
SCHEMBL9705877 0.70 CYP1A2 (0.53) ALDH1A1SMN1; SMN2HSD17B10CYP1A2
SCHEMBL1699127 0.69 NPC1 (0.50) GAAPKMHPGDMEN1KMT2A
SCHEMBL22580612 0.69 MEN1 (0.64) GAATLR9PKMHPGDMEN1
SCHEMBL12081988 0.69 MEN1 (0.64) GAATLR9PKMHPGDMEN1

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-9718821-B2 Pyridopyrimidinone inhibitors of kinases ABBVIE INC. (US) 2017-08-01 US disclosed
US-9718821-B2 Pyridopyrimidinone inhibitors of kinases ABBVIE INC. (US) 2017-08-01 US disclosed
EP-2817308-B1 PYRIDOPYRIMIDINONE INHIBITORS OF KINASES ABBVIE INC (US) 2016-09-07 EP disclosed
US-20130225589-A1 PYRIDOPYRIMIDINONE INHIBITORS OF KINASES ABBVIE INC. (US) 2013-08-29 US disclosed
WO-2013126656-A1 PYRIDOPYRIMIDINONE INHIBITORS OF KINASES ABBVIE INC. (US) 2013-08-29 WO 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-20130225589-A1 PYRIDOPYRIMIDINONE INHIBITORS OF KINASES WEE1, WEE2, CDK1 GAA 2624/4885TLR9 3742/4885PKM 432/4885

“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.