SCHEMBL24672397

SCHEMBL24672397

Clc1ccnc2[nH]cc(-c3ncccn3)c12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK9 P50750 4/20 0.57
▸ CDK5 Q00535 4/20 0.57
▸ CDK2 P24941 3/20 0.57
▸ CCNT1 O60563 2/20 0.57
▸ CCNA2 P20248 2/20 0.57
▸ CCNA1 P78396 2/20 0.57
▸ CDK5R1 Q15078 2/20 0.57
▸ LRRK2 Q5S007 6/20 0.57
▸ ROCK2 O75116 4/20 0.57
▸ ROCK1 Q13464 4/20 0.57
▸ DYRK1B Q9Y463 2/20 0.57
▸ CDC42BPA Q5VT25 2/20 0.57
▸ AXL P30530 2/20 0.57
▸ PRKCI P41743 2/20 0.57
▸ AURKB Q96GD4 2/20 0.57
▸ CDC7 O00311 2/20 0.57
▸ DAPK3 O43293 2/20 0.57
▸ MAP4K4 O95819 2/20 0.57
▸ PIM1 P11309 2/20 0.57
▸ PRKACA P17612 2/20 0.57

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
SCHEMBL30668694 0.82 CDK9 (0.61) CDK9CDK5CDK2CCNT1CCNA2
SCHEMBL20744107 0.82 CDK9 (0.61) CDK9CDK5CDK2CCNT1CCNA2
SCHEMBL24673076 0.80 ROCK2 (0.51) CDK9CDK5CDK2CCNT1CCNA2
SCHEMBL30668720 0.78 ROCK2 (0.60) CDK9CDK5CDK2CCNT1CCNA2
SCHEMBL20744209 0.78 ROCK2 (0.60) CDK9CDK5CDK2CCNT1CCNA2
SCHEMBL16785960 0.77 LRRK2 (0.62) CDK9CDK5CDK2CCNT1CCNA2
SCHEMBL24672968 0.77 ROCK1 (0.58) CDK9CDK5CDK2CCNT1CCNA2
SCHEMBL24672106 0.76 CDK2 (0.61) CDK9CDK5CDK2CCNT1CCNA2
SCHEMBL24672937 0.76 ROCK1 (0.57) CDK9CDK5CDK2CCNT1CCNA2
SCHEMBL24672633 0.74 CDK2 (0.52) CDK9CDK5CDK2CCNT1CCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11447505-B1 Pyrrolo[2,3-b]pyridine compounds and their use in the treatment of cancer CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2022-09-20 — — 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 (1 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-11447505-B1 Pyrrolo[2,3-b]pyridine compounds and their use in the treatment of cancer PDXK, CCNK, CDC42BPB CDK9 76/4885CDK5 257/4885CDK2 71/4885

“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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