SCHEMBL2605490

SCHEMBL2605490

N#CCC1(n2cc(-c3ncnc4[nH]ccc34)cn2)CNC1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 19/20 0.74
JAK1 P23458 18/20 0.74
JAK3 P52333 14/20 0.74
CIT O14578 1/20 0.71
GAK O14976 1/20 0.71
ROCK2 O75116 1/20 0.71
ULK1 O75385 1/20 0.71
PRKCB P05771 1/20 0.71
RET P07949 1/20 0.71
PRKCA P17252 1/20 0.71
PRKACA P17612 1/20 0.71
MARK3 P27448 1/20 0.71
TYK2 P29597 1/20 0.71
STAT3 P40763 1/20 0.71
CLK1 P49759 1/20 0.71
CSNK1G2 P78368 1/20 0.71
PRKCD Q05655 1/20 0.71
MAP3K1 Q13233 1/20 0.71
ROCK1 Q13464 1/20 0.71
TNK1 Q13470 1/20 0.71

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
Hydrochloric Acid SCHEMBL16007893 0.99 JAK2 (0.72) JAK2JAK1JAK3CITGAK
Hydrochloric Acid SCHEMBL29395202 0.99 JAK2 (0.72) JAK2JAK1JAK3CITGAK
SCHEMBL29541207 0.91 JAK2 (0.83) JAK2JAK1JAK3CITGAK
SCHEMBL100609 0.91 JAK2 (0.83) JAK2JAK1JAK3CITGAK
Trifluoroacetic Acid SCHEMBL871919 0.91 JAK2 (0.65) JAK2JAK1JAK3CITGAK
Trifluoroacetic Acid SCHEMBL870688 0.91 JAK2 (0.65) JAK2JAK1JAK3CITGAK
SCHEMBL102406 0.90 JAK2 (0.77) JAK2JAK1JAK3CITGAK
SCHEMBL871842 0.89 JAK2 (0.80) JAK2JAK1JAK3CITGAK
SCHEMBL100359 0.89 JAK2 (0.83) JAK2JAK1JAK3CITGAK
Tert-Butyl Formate SCHEMBL28050500 0.89 JAK2 (0.66) JAK2JAK1JAK3CITGAK

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3715347-B1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE HOLDINGS CORP (US) 2021-12-22 EP claimed
EP-2964650-B1 PROCESSES AND INTERMEDIATES FOR MAKING A JAK INHIBITOR INCYTE HOLDINGS CORP (US) 2018-12-05 EP claimed
EP-2545045-B1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE HOLDINGS CORP (US) 2016-01-06 EP claimed
EP-4400172-A2 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS Incyte Holdings Corporation (US) 2024-07-17 EP disclosed
US-11654143-B2 Therapeutic combinations of a BTK inhibitor, a PI3K inhibitor, a JAK-2 inhibitor, and/or a BCL-2 inhibitor ACERTA PHARMA B.V. (NL) 2023-05-23 US disclosed
EP-3985008-A1 PROCESSES AND INTERMEDIATES FOR MAKING A JAK INHIBITOR Incyte Holdings Corporation (US) 2022-04-20 EP disclosed
US-20220056034-A1 PROCESS AND INTERMEDIATES FOR PREPARING A JAK1 INHIBITOR INCYTE CORPORATION 2022-02-24 US disclosed
WO-2021254133-A1 SMALL MOLECULE COMPOUND 嘉兴特科罗生物科技有限公司 2021-12-23 WO disclosed
EP-3715347-B1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE HOLDINGS CORP (US) 2021-12-22 EP disclosed
EP-3489239-B1 PROCESSES AND INTERMEDIATES FOR MAKING A JAK INHIBITOR INCYTE HOLDINGS CORP (US) 2021-09-15 EP disclosed
WO-2021053690-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BARICITINIB NATCO PHARMA LIMITED (IN) 2021-03-25 WO disclosed
WO-2013026025-A1 CYCLOHEXYL AZETIDINE DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION (US) 2013-02-21 WO disclosed
US-8158616-B2 Azetidine and cyclobutane derivatives as JAK inhibitors INCYTE CORPORATION (US) 2012-04-17 US disclosed
US-8158616-B2 Azetidine and cyclobutane derivatives as JAK inhibitors INCYTE CORPORATION (US) 2012-04-17 US disclosed
US-20120077798-A1 AZETIDINE AND CYCLOBUTANE DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION 2012-03-29 US disclosed
US-20120077798-A1 AZETIDINE AND CYCLOBUTANE DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION 2012-03-29 US disclosed
WO-2011112662-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS INCYTE CORPORATION (US) 2011-09-15 WO disclosed
WO-2009114512-A1 AZETIDINE AND CYCLOBUTANE DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION (US) 2009-09-17 WO disclosed
US-20090233903-A1 AZETIDINE AND CYCLOBUTANE DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION (US) 2009-09-17 US disclosed
US-20090233903-A1 AZETIDINE AND CYCLOBUTANE DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION (US) 2009-09-17 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 (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-20220056034-A1 PROCESS AND INTERMEDIATES FOR PREPARING A JAK1 INHIBITOR JAK1, JAK2, JAK3 JAK2 2/4885JAK1 1/4885JAK3 3/4885
US-11654143-B2 Therapeutic combinations of a BTK inhibitor, a PI3K inhibitor, a JAK-2 inhibitor, and/or a BCL-2 inhibitor BTK, JAK2, BCL9 JAK2 2/4885JAK1 5/4885JAK3 8/4885
US-20090233903-A1 AZETIDINE AND CYCLOBUTANE DERIVATIVES AS JAK INHIBITORS JAK1, JAK2, JAK3 JAK2 2/4885JAK1 1/4885JAK3 3/4885
US-20120077798-A1 AZETIDINE AND CYCLOBUTANE DERIVATIVES AS JAK INHIBITORS JAK1, JAK2, JAK3 JAK2 2/4885JAK1 1/4885JAK3 3/4885

“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.