SCHEMBL24672919

SCHEMBL24672919

CN(C(=O)OC(C)(C)C)[C@H]1CCCN(c2ccnc3[nH]cc(C#N)c23)C1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CDC42BPB Q9Y5S2 20/20 0.59
ROCK2 O75116 19/20 0.59
ROCK1 Q13464 19/20 0.59
CDC42BPA Q5VT25 6/20 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
SCHEMBL24672398 0.84 ROCK1 (0.62) CDC42BPBROCK2ROCK1CDC42BPA
SCHEMBL24672436 0.84 ROCK1 (0.61) CDC42BPBROCK2ROCK1CDC42BPA
SCHEMBL24673154 0.83 ROCK2 (0.72) CDC42BPBROCK2ROCK1CDC42BPA
SCHEMBL24673162 0.83 ROCK2 (0.72) CDC42BPBROCK2ROCK1CDC42BPA
SCHEMBL24672127 0.83 ROCK2 (0.72) CDC42BPBROCK2ROCK1CDC42BPA
SCHEMBL24672666 0.83 ROCK1 (0.61) CDC42BPBROCK2ROCK1CDC42BPA
SCHEMBL24672664 0.83 ROCK2 (0.63) CDC42BPBROCK2ROCK1CDC42BPA
SCHEMBL24672432 0.81 ROCK1 (0.62) CDC42BPBROCK2ROCK1CDC42BPA
SCHEMBL24672415 0.81 ROCK1 (0.62) CDC42BPBROCK2ROCK1CDC42BPA
SCHEMBL24673069 0.81 ROCK1 (0.45) CDC42BPBROCK2ROCK1CDC42BPA

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 CDC42BPB 3/4885ROCK2 1115/4885ROCK1 1054/4885

“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.