SCHEMBL21836069

SCHEMBL21836069

NC(=O)c1cccn2c(=O)c3ccccc3nc12

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.79
HSD17B10 Q99714 4/20 0.79
CASP1 P29466 2/20 0.79
CASP7 P55210 2/20 0.79
POLR1A O95602 4/20 0.59
ALDH1A1 P00352 6/20 0.57
HPGD P15428 3/20 0.57
GLA P06280 2/20 0.57
GAA P10253 2/20 0.57
HTT P42858 1/20 0.57
SMN1; SMN2 Q16637 3/20 0.53
TSHR P16473 3/20 0.53
NPSR1 Q6W5P4 1/20 0.53
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52

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
SCHEMBL18631335 0.88 KDM4E (1.00) KDM4EHSD17B10CASP1CASP7POLR1A
SCHEMBL17117513 0.85 POLR1A (0.64) KDM4EHSD17B10CASP1CASP7POLR1A
SCHEMBL21798882 0.82 KDM4E (0.73) KDM4EHSD17B10CASP1CASP7POLR1A
SCHEMBL5775612 0.81 KDM4E (0.51) KDM4EHSD17B10CASP1CASP7POLR1A
SCHEMBL28665936 0.76 KDM4E (0.64) KDM4EHSD17B10CASP1CASP7POLR1A
SCHEMBL21798925 0.76 POLR1A (0.47) KDM4EHSD17B10CASP1CASP7POLR1A
SCHEMBL29646595 0.75 KDM4E (0.75) KDM4EHSD17B10CASP1CASP7POLR1A
SCHEMBL17099654 0.75 KDM4E (0.75) KDM4EHSD17B10CASP1CASP7POLR1A
SCHEMBL21798918 0.74 POLR1A (0.61) KDM4EHSD17B10CASP1CASP7POLR1A
SCHEMBL21798889 0.74 POLR1A (0.61) KDM4EHSD17B10CASP1CASP7POLR1A

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-111247143-B Pyridoquinazoline derivatives useful as inhibitors of protein kinases 昂科斯特拉公司 2022-07-05 CN disclosed
US-11021479-B2 Pyridoquinazoline derivatives useful as protein kinase inhibitors ONCOSTELLAE, S.L. (ES) 2021-06-01 US disclosed
EP-3632912-B1 PYRIDOQUINAZOLINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS ONCOSTELLAE S L (ES) 2021-03-17 EP disclosed
US-20200148676-A1 PYRIDOQUINAZOLINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS ONCOSTELLAE, S.L. (ES) 2020-05-14 US disclosed
EP-3632912-A1 PYRIDOQUINAZOLINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS Oncostellae, S.L. (ES) 2020-04-08 EP 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-20200148676-A1 PYRIDOQUINAZOLINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS MAP4K2, MAP4K1, MAP4K3 KDM4E 1078/4885HSD17B10 4415/4885CASP1 1565/4885
US-11021479-B2 Pyridoquinazoline derivatives useful as protein kinase inhibitors MAP4K2, MAP4K1, MAP4K3 KDM4E 1078/4885HSD17B10 4415/4885CASP1 1565/4885

“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.