SCHEMBL29869596

SCHEMBL29869596

Cc1cnc(-c2c[nH]c3ncccc23)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 4/20 0.51
IKBKE Q14164 3/20 0.51
PDPK1 O15530 3/20 0.51
RPS6KA5 O75582 1/20 0.50
TBK1 Q9UHD2 3/20 0.48
DYRK1A Q13627 4/20 0.47
BRD4 O60885 1/20 0.46
CDC7 O00311 3/20 0.46
CDK2 P24941 2/20 0.46
MAP4K4 O95819 2/20 0.46
PIM1 P11309 2/20 0.46
PRKACA P17612 2/20 0.46
GSK3B P49841 2/20 0.46
HIPK2 Q9H2X6 2/20 0.46
CLK4 Q9HAZ1 2/20 0.46
CDK9 P50750 2/20 0.46
CDK5 Q00535 2/20 0.46
ROCK2 O75116 1/20 0.46
IRAK4 Q9NWZ3 1/20 0.46
CCNT1 O60563 1/20 0.46

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
SCHEMBL13888072 0.82 TBK1 (0.53) TGFBR1IKBKEPDPK1RPS6KA5TBK1
SCHEMBL12281270 0.79 PDPK1 (0.48) TGFBR1IKBKEPDPK1RPS6KA5TBK1
SCHEMBL858166 0.79 MAP3K5 (0.54) TGFBR1IKBKEPDPK1RPS6KA5TBK1
SCHEMBL1797960 0.77 AXL (0.66) GSK3BAXLCAMKK2CDK8
SCHEMBL5618155 0.77 TGFBR1 (0.71) TGFBR1IKBKEPDPK1RPS6KA5TBK1
SCHEMBL13521575 0.77 DYRK1A (0.50) TGFBR1IKBKEPDPK1RPS6KA5TBK1
SCHEMBL24672103 0.74 ROCK1 (0.53) IKBKEPDPK1RPS6KA5TBK1CDC7
SCHEMBL30668749 0.74 TGFBR1 (0.51) TGFBR1IKBKEPDPK1RPS6KA5TBK1
SCHEMBL2241248 0.74 TGFBR1 (0.51) TGFBR1IKBKEPDPK1RPS6KA5TBK1
SCHEMBL29870401 0.74 CDC7 (0.60) TGFBR1IKBKEPDPK1RPS6KA5TBK1

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 claimed

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 TGFBR1 4808/4885IKBKE 506/4885PDPK1 46/4885

“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.