SCHEMBL29540630

SCHEMBL29540630

COc1cccc(CS(=O)(=O)c2cccc(C(CC#N)n3cc(-c4ncnc5[nH]ccc45)cn3)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 16/20 0.49
JAK1 P23458 14/20 0.49
FGFR1 P11362 2/20 0.48
KDR P35968 1/20 0.48
JAK3 P52333 8/20 0.47
ROCK2 O75116 4/20 0.47
RET P07949 3/20 0.47
ROCK1 Q13464 3/20 0.47
TYK2 P29597 3/20 0.47
DAPK3 O43293 2/20 0.47
PAK4 O96013 2/20 0.47
ABL1 P00519 2/20 0.47
LTK P29376 2/20 0.47
CSNK1A1 P48729 2/20 0.47
CLK2 P49760 2/20 0.47
TNK2 Q07912 2/20 0.47
DYRK1A Q13627 2/20 0.47
IKBKE Q14164 2/20 0.47
NTRK3 Q16288 2/20 0.47
NTRK2 Q16620 2/20 0.47

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
SCHEMBL99316 1.00 JAK2 (0.49) JAK2JAK1FGFR1KDRJAK3
SCHEMBL100426 0.94 JAK2 (0.49) JAK2JAK1FGFR1KDRJAK3
SCHEMBL29540646 0.91 JAK2 (0.51) JAK2JAK1FGFR1JAK3ROCK2
SCHEMBL99793 0.91 JAK2 (0.51) JAK2JAK1FGFR1JAK3ROCK2
SCHEMBL29540634 0.89 JAK1 (0.49) JAK2JAK1FGFR1JAK3ROCK2
SCHEMBL101632 0.89 JAK1 (0.49) JAK2JAK1FGFR1JAK3ROCK2
SCHEMBL29540613 0.89 JAK2 (0.48) JAK2JAK1FGFR1KDRJAK3
SCHEMBL102000 0.89 JAK2 (0.48) JAK2JAK1FGFR1KDRJAK3
SCHEMBL102887 0.88 JAK2 (0.59) JAK2JAK1FGFR1KDRJAK3
SCHEMBL101674 0.88 JAK2 (0.52) JAK2JAK1FGFR1KDRJAK3

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 2/4885FGFR1 424/4885
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 2/4885FGFR1 424/4885
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 2/4885FGFR1 424/4885

“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.