SCHEMBL3243144

SCHEMBL3243144

Ic1cnc2cccnn12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.53
DYRK1A Q13627 3/20 0.44
KLK7 P49862 1/20 0.41
PDE4A P27815 1/20 0.36
HDAC1 Q13547 4/20 0.35
SSTR4 P31391 1/20 0.35
HSD11B1 P28845 1/20 0.35
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
LRRK2 Q5S007 1/20 0.34
DGAT1 O75907 2/20 0.33
KDR P35968 1/20 0.33
DYRK3 O43781 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
DYRK2 Q92630 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
CDK1 P06493 1/20 0.32

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
SCHEMBL5494796 0.75 MKNK1 (0.53) MKNK1DYRK1AKLK7PDE4ASSTR4
SCHEMBL22510132 0.75 MKNK1 (0.53) MKNK1DYRK1AKLK7SSTR4HSD11B1
SCHEMBL19493139 0.75 MKNK1 (0.53) MKNK1DYRK1AKLK7PDE4ASSTR4
SCHEMBL2392859 0.75 MKNK1 (0.53) MKNK1DYRK1AKLK7HDAC1SSTR4
SCHEMBL477032 0.75 MKNK1 (0.53) MKNK1DYRK1AKLK7PDE4ASSTR4
SCHEMBL24244798 0.75 MKNK1 (0.49) MKNK1DYRK1AKLK7PDE4ASSTR4
SCHEMBL6842146 0.75 MKNK1 (0.49) MKNK1DYRK1AKLK7PDE4ASSTR4
Hydrochloric Acid SCHEMBL16324142 0.73 MKNK1 (0.51) MKNK1DYRK1AKLK7HDAC1SSTR4
SCHEMBL22369939 0.72 MKNK1 (0.46) MKNK1DYRK1AKLK7
SCHEMBL21103954 0.72 MKNK1 (0.46) MKNK1DYRK1AKLK7PDE4ASSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240400577-A1 MODULATORS OF PROTEIN KINASES VIBLIOME THERAPEUTICS, LLC 2024-12-05 US disclosed
WO-2023283369-A1 MODULATORS OF PROTEIN KINASES VIBLIOME THERAPEUTICS, LLC (US) 2023-01-12 WO disclosed
US-20220185817-A1 IRAK4 INHIBITORS ASTRAZENECA AB (SE) 2022-06-16 US disclosed
WO-2021048567-A1 NEW COMPOUNDS AND METHODS BENEVOLENTAI BIO LIMITED (GB) 2021-03-18 WO disclosed
CN-111004240-B Synthetic method of ponatinib intermediate 3-ethynylimidazo [1,2-b ] pyridazine 山东铂源药业有限公司 2020-12-01 CN disclosed
US-20200123165-A1 KINASE INHIBITORS INSILICO MEDICINE LTD. (CN) 2020-04-23 US disclosed
CN-111004240-A Synthetic method of ponatinib intermediate 3-ethynylimidazo [1,2-b ] pyridazine 山东铂源药业有限公司 2020-04-14 CN disclosed
EP-2997021-B1 NEW SOMATOSTATIN RECEPTOR SUBTYPE 4 (SSTR4) AGONISTS CENTREXION THERAPEUTICS CORP (US) 2017-12-20 EP disclosed
US-9789082-B2 Somatostatin receptor subtype 4 (SSTR4) agonists CENTREXION THERAPEUTICS CORPORATION (US) 2017-10-17 US disclosed
US-20170014381-A1 NEW SOMATOSTATIN RECEPTOR SUBTYPE 4 (SSTR4) AGONISTS ANKURA TRUST COMPANY, LLC, AS ADMINISTRATIVE AND COLLATERAL AGENT 2017-01-19 US disclosed
WO-2015143012-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF PI3K-GAMMA MEDIATED DISORDERS INFINITY PHARMACEUTICALS, INC. (US) 2015-09-24 WO disclosed
WO-2015051244-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INFINITY PHARMACEUTICALS, INC. (US) 2015-04-09 WO disclosed
WO-2013154878-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INFINITY PHARMACEUTICALS, INC. (US) 2013-10-17 WO disclosed
WO-2010034500-A1 SUBSTITUTED IMIDAZOPYRIDINE, IMIDAZOPYRAZINE, IMIDAZOPYRIDAZINE AND IMIDAZOPYRIMIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR ANTAGONISTS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2010-04-01 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 (4 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-20240400577-A1 MODULATORS OF PROTEIN KINASES MAP3K20, PRKCE, PRKCH MKNK1 25/4885DYRK1A 822/4885KLK7 4048/4885
US-20170014381-A1 NEW SOMATOSTATIN RECEPTOR SUBTYPE 4 (SSTR4) AGONISTS SSTR4, SSTR3, SSTR1 MKNK1 3140/4885DYRK1A 2164/4885KLK7 3521/4885
US-20220185817-A1 IRAK4 INHIBITORS IRAK4, IRAK2, IRAK1 MKNK1 344/4885DYRK1A 2486/4885KLK7 3286/4885
US-20200123165-A1 KINASE INHIBITORS DDR1, DDR2, DDRGK1 MKNK1 225/4885DYRK1A 22/4885KLK7 2496/4885

“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.