SCHEMBL24672994

SCHEMBL24672994

Fc1cncc(-c2c[nH]c3nccc(Cl)c23)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 11/20 0.62
▸ ROCK1 Q13464 11/20 0.62
▸ CDC42BPB Q9Y5S2 10/20 0.62
▸ CDK2 P24941 2/20 0.51
▸ CDK9 P50750 2/20 0.51
▸ CDK5 Q00535 2/20 0.51
▸ LRRK2 Q5S007 2/20 0.51
▸ CDC42BPA Q5VT25 2/20 0.51
▸ CDC7 O00311 1/20 0.51
▸ PLK4 O00444 1/20 0.51
▸ CHEK1 O14757 1/20 0.51
▸ MAPK13 O15264 1/20 0.51
▸ PDPK1 O15530 1/20 0.51
▸ DAPK3 O43293 1/20 0.51
▸ DYRK3 O43781 1/20 0.51
▸ PRKD3 O94806 1/20 0.51
▸ MAP4K4 O95819 1/20 0.51
▸ ABL1 P00519 1/20 0.51
▸ PRKCG P05129 1/20 0.51
▸ CDK1 P06493 1/20 0.51

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
SCHEMBL24672968 0.83 ROCK1 (0.58) ROCK2ROCK1CDC42BPBCDK2CDK9
SCHEMBL20758388 0.82 ROCK2 (0.60) ROCK2ROCK1CDC42BPBCDK2CDC42BPA
SCHEMBL20744209 0.80 ROCK2 (0.60) ROCK2ROCK1CDC42BPBCDK2CDK9
SCHEMBL30668720 0.80 ROCK2 (0.60) ROCK2ROCK1CDC42BPBCDK2CDK9
SCHEMBL24672681 0.77 ROCK1 (1.00) ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL29869562 0.77 ROCK1 (1.00) ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL24672937 0.76 ROCK1 (0.57) ROCK2ROCK1CDC42BPBCDK2CDK9
SCHEMBL20758425 0.75 CDK2 (0.57) ROCK2ROCK1CDC42BPBCDK2CDK9
SCHEMBL20744032 0.74 ROCK2 (0.60) ROCK2ROCK1CDC42BPBCDK2CDK9
SCHEMBL30668710 0.74 ROCK2 (0.60) ROCK2ROCK1CDC42BPBCDK2CDK9

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

“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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