SCHEMBL29541690

SCHEMBL29541690

Cc1nn(-c2ccnc3[nH]ccc23)cc1-c1cccc(CO)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK8 P49336 2/20 0.42
▸ NUDT1 P36639 2/20 0.41
▸ PIK3CA P42336 1/20 0.41
▸ MTOR P42345 1/20 0.41
▸ PRKCI P41743 4/20 0.41
▸ IKBKB O14920 2/20 0.41
▸ CHUK O15111 2/20 0.41
▸ LRRK2 Q5S007 2/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ DAPK3 O43293 1/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ PRKD3 O94806 1/20 0.41
▸ MAP4K4 O95819 1/20 0.41
▸ PAK4 O96013 1/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ RET P07949 1/20 0.41
▸ IGF1R P08069 1/20 0.41
▸ FGFR1 P11362 1/20 0.41
▸ PRKACA P17612 1/20 0.41
▸ FLT1 P17948 1/20 0.41

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
SCHEMBL100558 1.00 CDK8 (0.42) CDK8NUDT1PIK3CAMTORPRKCI
SCHEMBL18599321 0.91 LRRK2 (0.43) CDK8NUDT1PRKCIIKBKBCHUK
SCHEMBL98273 0.86 AURKB (0.56) CDK8NUDT1PRKCIIKBKBCHUK
SCHEMBL29540441 0.86 AURKB (0.56) CDK8NUDT1PRKCIIKBKBCHUK
SCHEMBL29540479 0.84 MAP4K4 (0.46) CDK8NUDT1PRKCIIKBKBCHUK
SCHEMBL98811 0.84 MAP4K4 (0.46) CDK8NUDT1PRKCIIKBKBCHUK
SCHEMBL99271 0.82 BRD4 (0.46) CDK8NUDT1PIK3CAPRKCIIKBKB
SCHEMBL29540881 0.82 BRD4 (0.46) CDK8NUDT1PIK3CAPRKCIIKBKB
SCHEMBL16692485 0.81 PRKCI (0.48) CDK8NUDT1PIK3CAPRKCIIKBKB
SCHEMBL856851 0.79 IKBKB (0.66) CDK8NUDT1PRKCIIKBKBCHUK

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 CDK8 200/4885NUDT1 1879/4885PIK3CA 72/4885
US-11744832-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors JAK3, JAK1, JAK2 CDK8 200/4885NUDT1 1879/4885PIK3CA 72/4885
US-11331320-B2 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors JAK3, JAK1, JAK2 CDK8 200/4885NUDT1 1879/4885PIK3CA 72/4885

“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.

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