SCHEMBL24672634

SCHEMBL24672634

Cc1nc(-c2c[nH]c3nccc(Cl)c23)cs1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 9/20 0.58
CDK5 Q00535 9/20 0.58
CDK2 P24941 8/20 0.58
CCNT1 O60563 8/20 0.58
CDK5R1 Q15078 8/20 0.58
CCNA2 P20248 7/20 0.58
CCNA1 P78396 7/20 0.58
ROCK1 Q13464 4/20 0.50
CDC42BPB Q9Y5S2 1/20 0.50
CYP3A4 P08684 2/20 0.47
LRRK2 Q5S007 3/20 0.45
CDC7 O00311 1/20 0.45
PLK4 O00444 1/20 0.45
CHEK1 O14757 1/20 0.45
MAPK13 O15264 1/20 0.45
PDPK1 O15530 1/20 0.45
DAPK3 O43293 1/20 0.45
DYRK3 O43781 1/20 0.45
ROCK2 O75116 1/20 0.45
PRKD3 O94806 1/20 0.45

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
SCHEMBL1840300 0.85 CDK9 (0.67) CDK9CDK5CDK2CCNT1CDK5R1
SCHEMBL20758174 0.80 CDK2 (0.52) CDK9CDK5CDK2CCNT1CDK5R1
SCHEMBL20758175 0.79 CDK2 (0.70) CDK9CDK5CDK2CCNT1CDK5R1
SCHEMBL2239702 0.73 CDK5 (1.00) CDK9CDK5CDK2CCNT1CDK5R1
SCHEMBL24672940 0.73 LRRK2 (0.48) CDK9CDK5CDK2CCNT1CDK5R1
SCHEMBL1802877 0.73 ROCK1 (0.46) CDK9CDK5CDK2CCNT1CDK5R1
SCHEMBL24672937 0.73 ROCK1 (0.57) CDK9CDK5CDK2CCNT1CDK5R1
SCHEMBL20744107 0.73 CDK9 (0.61) CDK9CDK5CDK2CCNT1CDK5R1
SCHEMBL24672106 0.73 CDK2 (0.61) CDK9CDK5CDK2CCNT1CDK5R1
SCHEMBL30668694 0.73 CDK9 (0.61) CDK9CDK5CDK2CCNT1CDK5R1

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.