SCHEMBL29541194

SCHEMBL29541194

Cc1nn(-c2ccnc3[nH]ccc23)cc1-c1cncnc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 3/20 0.49
NUDT1 P36639 3/20 0.44
AURKB Q96GD4 3/20 0.43
AURKA O14965 2/20 0.43
INCENP Q9NQS7 2/20 0.43
TPX2 Q9ULW0 2/20 0.43
ROCK1 Q13464 7/20 0.41
CDC42BPB Q9Y5S2 6/20 0.41
ROCK2 O75116 5/20 0.41
GRM4 Q14833 1/20 0.40
CDC42BPA Q5VT25 1/20 0.40
CCNK O75909 1/20 0.40
CDK12 Q9NYV4 1/20 0.40
CSNK1D P48730 1/20 0.38
MAPK11 Q15759 1/20 0.38
MAPK14 Q16539 1/20 0.38
AKT2 P31751 1/20 0.38
IKBKB O14920 1/20 0.38
CHUK O15111 1/20 0.38
DAPK3 O43293 1/20 0.38

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
SCHEMBL99682 1.00 PRKCI (0.49) PRKCINUDT1AURKBAURKAINCENP
SCHEMBL16692485 0.85 PRKCI (0.48) PRKCINUDT1AURKBAURKAINCENP
SCHEMBL29540441 0.85 AURKB (0.56) PRKCINUDT1AURKBAURKAINCENP
SCHEMBL98273 0.85 AURKB (0.56) PRKCINUDT1AURKBAURKAINCENP
SCHEMBL99293 0.82 PRKCI (0.45) PRKCINUDT1AURKBAURKAINCENP
SCHEMBL29541139 0.82 PRKCI (0.45) PRKCINUDT1AURKBAURKAINCENP
SCHEMBL100026 0.81 PRKCI (0.44) PRKCINUDT1AURKBAURKAINCENP
SCHEMBL29540476 0.81 PRKCI (0.44) PRKCINUDT1AURKBAURKAINCENP
SCHEMBL99826 0.81 PRKCI (0.44) PRKCIAURKBAURKAINCENPTPX2
SCHEMBL29540628 0.81 PRKCI (0.44) PRKCIAURKBAURKAINCENPTPX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PRKCI 304/4885NUDT1 1879/4885AURKB 198/4885
US-11744832-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors JAK3, JAK1, JAK2 PRKCI 304/4885NUDT1 1879/4885AURKB 198/4885
US-11331320-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors JAK3, JAK1, JAK2 PRKCI 304/4885NUDT1 1879/4885AURKB 198/4885

“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.