SCHEMBL25439367

SCHEMBL25439367

O=C(O)CNC(=O)Cn1cc(-c2ccnc3ccccc23)c(-c2ccccn2)n1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 13/20 0.63
▸ MAPK14 Q16539 8/20 0.63
▸ AURKA O14965 2/20 0.43
▸ AURKB Q96GD4 2/20 0.43
▸ FTO Q9C0B1 1/20 0.41
▸ KDM5B Q9UGL1 1/20 0.41
▸ KDM2A Q9Y2K7 1/20 0.41
▸ THRB P10828 1/20 0.40
▸ TGFBR2 P37173 1/20 0.39
▸ ABL2 P42684 1/20 0.39
▸ CSNK1A1 P48729 1/20 0.39
▸ CSNK1D P48730 1/20 0.39
▸ MAP3K20 Q9NYL2 1/20 0.39
▸ PTGDR2 Q9Y5Y4 1/20 0.37

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
SCHEMBL30556508 1.00 TGFBR1 (0.63) TGFBR1MAPK14AURKAAURKBFTO
SCHEMBL28822071 0.90 TGFBR1 (0.69) TGFBR1MAPK14AURKAAURKB
SCHEMBL31519383 0.86 TGFBR1 (0.61) TGFBR1MAPK14AURKAAURKBTHRB
Hydrochloric Acid SCHEMBL23409670 0.85 TGFBR1 (0.60) TGFBR1MAPK14AURKAAURKBTHRB
SCHEMBL23409664 0.85 TGFBR1 (0.59) TGFBR1MAPK14AURKAAURKBTHRB
SCHEMBL23409951 0.85 TGFBR1 (0.59) TGFBR1MAPK14AURKAAURKBTHRB
SCHEMBL29959820 0.85 TGFBR1 (0.59) TGFBR1MAPK14AURKAAURKBTHRB
SCHEMBL28822090 0.85 TGFBR1 (0.62) TGFBR1MAPK14THRB
SCHEMBL28822077 0.85 TGFBR1 (0.59) TGFBR1MAPK14
SCHEMBL23409854 0.84 TGFBR1 (0.56) TGFBR1MAPK14AURKAAURKBTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12577230-B2 2-(3-pyridin-2-yl-4-quinolin-4-yl-pyrazol-1-yl)- acetamide derivatives as inhibitors of transforming growth factor-beta receptor I/ALK5 AGOMAB SPAIN S.L.U. (ES) 2026-03-17 — — US disclosed
US-20230373966-A1 2-(3-PYRIDIN-2-YL-4-QUINOLIN-4-YL-PYRAZOL-1-YL)-ACETAMIDE DERIVATIVES AS INHIBITORS OF TRANSFORMING GROWTH FACTOR-BETA RECEPTOR I/ALK5 AGOMAB SPAIN S.L.U. (ES) 2023-11-23 — — US disclosed
EP-4222149-A1 2-(3-PYRIDIN-2-YL-4-QUINOLIN-4-YL-PYRAZOL-1-YL)-ACETAMIDE DERIVATIVES AS INHIBITORS OF TRANSFORMING GROWTH FACTOR-BETA RECEPTOR I/ALK5 AgomAb Spain, S.L.U. (ES) 2023-08-09 — — EP disclosed
CN-116323601-A 2- (3-pyridin-2-yl-4-quinolin-4-yl-pyrazol-1-yl) -acetamide derivatives as transforming growth factor-beta receptor I/ALK5 inhibitors 阿戈麦布西班牙股份有限公司 2023-06-23 — — CN 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 (2 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-12577230-B2 2-(3-pyridin-2-yl-4-quinolin-4-yl-pyrazol-1-yl)- acetamide derivatives as inhibitors of transforming growth factor-beta receptor I/ALK5 TGFBR1, TGFBR2, ACVR1 TGFBR1 1/4885MAPK14 845/4885AURKA 939/4885
US-20230373966-A1 2-(3-PYRIDIN-2-YL-4-QUINOLIN-4-YL-PYRAZOL-1-YL)-ACETAMIDE DERIVATIVES AS INHIBITORS OF TRANSFORMING GROWTH FACTOR-BETA RECEPTOR I/ALK5 ACVR1, ACVRL1, TGFBR2 TGFBR1 4/4885MAPK14 638/4885AURKA 99/4885

“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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