SCHEMBL29540693

SCHEMBL29540693

CCC(C/C=N/O)n1cc(-c2ncnc3[nH]ccc23)cn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 18/20 0.58
JAK1 P23458 11/20 0.58
HDAC6 Q9UBN7 8/20 0.51
JAK3 P52333 7/20 0.51
TYK2 P29597 6/20 0.51
HDAC1 Q13547 6/20 0.51
RET P07949 3/20 0.51
ROCK1 Q13464 3/20 0.51
DAPK3 O43293 2/20 0.51
PAK4 O96013 2/20 0.51
ABL1 P00519 2/20 0.51
LTK P29376 2/20 0.51
CSNK1A1 P48729 2/20 0.51
CLK2 P49760 2/20 0.51
TNK2 Q07912 2/20 0.51
DYRK1A Q13627 2/20 0.51
IKBKE Q14164 2/20 0.51
NTRK3 Q16288 2/20 0.51
NTRK2 Q16620 2/20 0.51
LRRK2 Q5S007 2/20 0.51

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
SCHEMBL101326 1.00 JAK2 (0.58) JAK2JAK1HDAC6JAK3TYK2
SCHEMBL101325 1.00 JAK2 (0.58) JAK2JAK1HDAC6JAK3TYK2
SCHEMBL12505740 1.00 JAK2 (0.58) JAK2JAK1HDAC6JAK3TYK2
Trifluoroacetic Acid SCHEMBL4095945 0.92 JAK2 (0.51) JAK2JAK1HDAC6JAK3TYK2
Trifluoroacetic Acid SCHEMBL4095960 0.92 JAK2 (0.51) JAK2JAK1HDAC6JAK3TYK2
SCHEMBL12251377 0.92 JAK2 (0.60) JAK2JAK1HDAC6JAK3TYK2
SCHEMBL21974416 0.90 JAK2 (0.60) JAK2JAK1HDAC6JAK3TYK2
SCHEMBL99436 0.88 JAK2 (0.56) JAK2JAK1HDAC6JAK3TYK2
SCHEMBL101302 0.88 JAK2 (0.56) JAK2JAK1HDAC6JAK3TYK2
SCHEMBL99437 0.88 JAK2 (0.56) JAK2JAK1HDAC6JAK3TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3838903-B1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE AS JANUS KINASE INHIBITOR INCYTE HOLDINGS CORP (US) 2023-11-22 EP disclosed
US-11744832-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors INCYTE CORPORATION (US) 2023-09-05 US disclosed
US-20220395506-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION 2022-12-15 US disclosed
US-11331320-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors INCYTE HOLDINGS CORPORATION (US) 2022-05-17 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 (3 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-20220395506-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS JAK3, JAK1, JAK2 JAK2 3/4885JAK1 2/4885HDAC6 2492/4885
US-11744832-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors JAK3, JAK1, JAK2 JAK2 3/4885JAK1 2/4885HDAC6 2492/4885
US-11331320-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors JAK3, JAK1, JAK2 JAK2 3/4885JAK1 2/4885HDAC6 2492/4885

“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.