SCHEMBL12907189

SCHEMBL12907189

CC(C)(C)c1ccc(-c2ccc3[nH]nc(N)c3c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 19/20 0.66
JAK3 P52333 5/20 0.59
TYK2 P29597 4/20 0.56
PLK4 O00444 3/20 0.56
DAPK3 O43293 3/20 0.56
DYRK3 O43781 3/20 0.56
ROCK2 O75116 3/20 0.56
MAP4K4 O95819 3/20 0.56
CDK1 P06493 3/20 0.56
CDK2 P24941 3/20 0.56
MARK3 P27448 3/20 0.56
CLK2 P49760 3/20 0.56
CDK5 Q00535 3/20 0.56
PRKCD Q05655 3/20 0.56
ROCK1 Q13464 3/20 0.56
DYRK1A Q13627 3/20 0.56
PKN2 Q16513 3/20 0.56
MARK2 Q7KZI7 3/20 0.56
AURKB Q96GD4 3/20 0.56
PRKD2 Q9BZL6 3/20 0.56

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
SCHEMBL1142228 0.89 JAK2 (0.64) JAK2JAK3TYK2PLK4DAPK3
Hydrochloric Acid SCHEMBL1141989 0.88 JAK2 (0.62) JAK2JAK3TYK2PLK4DAPK3
SCHEMBL6479720 0.87 JAK2 (0.66) JAK2JAK3CDK2ROCK1AURKB
SCHEMBL1690470 0.86 JAK2 (0.55) JAK2JAK3TYK2PLK4DAPK3
SCHEMBL28871206 0.86 JAK2 (0.65) JAK2JAK3TYK2PLK4DAPK3
SCHEMBL29968032 0.86 JAK2 (0.65) JAK2JAK3TYK2PLK4DAPK3
SCHEMBL10213929 0.84 JAK2 (0.81) JAK2JAK3TYK2PLK4DAPK3
SCHEMBL22339348 0.84 JAK2 (0.51) JAK2JAK3MITFALDH1A1TP53
SCHEMBL12907182 0.84 JAK2 (0.69) JAK2JAK3TYK2PLK4DAPK3
SCHEMBL11911445 0.83 JAK2 (0.55) JAK2JAK3TYK2PLK4DAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115260165-B Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof 中国科学院上海药物研究所 2024-08-06 CN disclosed
CN-115260165-A Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof 中国科学院上海药物研究所 2022-11-01 CN disclosed
US-7872039-B2 N-3-chlorobenzyl-3-amino-1H-indazole-5-carboxamide; 3-aminoindazoles; glucocorticoid-depedent kinase (SGK) inhibitors; SGK-induced diseases; diabetes, obesity, metabolic syndrome (dyslipidaemia), systemic and pulmonary hypertonia, cardiovascular diseases and renal diseases, fibrosis; inflammatory agents MERCK PATENT GESELLSCHAFT (DE) 2011-01-18 US disclosed
US-7872039-B2 N-3-chlorobenzyl-3-amino-1H-indazole-5-carboxamide; 3-aminoindazoles; glucocorticoid-depedent kinase (SGK) inhibitors; SGK-induced diseases; diabetes, obesity, metabolic syndrome (dyslipidaemia), systemic and pulmonary hypertonia, cardiovascular diseases and renal diseases, fibrosis; inflammatory agents MERCK PATENT GESELLSCHAFT (DE) 2011-01-18 US disclosed
EP-1765788-B1 3-AMINOINDAZOLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF SGK-ASSOCIATED DISEASES MERCK PATENT GMBH (DE) 2009-06-03 EP disclosed
US-20070232620-A1 3-Aminoindazoles MERCK PATENT GMBH (DE) 2007-10-04 US disclosed
US-20070232620-A1 3-Aminoindazoles MERCK PATENT GMBH (DE) 2007-10-04 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-20070232620-A1 3-Aminoindazoles SGK3, SGK1, SGK2 JAK2 562/4885JAK3 180/4885TYK2 140/4885

“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.