SCHEMBL25696142

SCHEMBL25696142

Cc1ccc2[nH]nc(C(N)=O)c2c1C(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP2K4 P45985 4/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ MAPKAPK2 P49137 1/20 0.35
▸ MAPKAPK3 Q16644 1/20 0.35
▸ MAPK6 Q16659 1/20 0.35
▸ MAPKAPK5 Q8IW41 1/20 0.35
▸ JAK2 O60674 1/20 0.33
▸ JAK1 P23458 1/20 0.33
▸ TYK2 P29597 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ TLR8 Q9NR97 1/20 0.32
▸ TLR7 Q9NYK1 1/20 0.32
▸ CTNNB1 P35222 1/20 0.32
▸ WNT3A P56704 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ DYRK1A Q13627 2/20 0.32
▸ NTRK1 P04629 1/20 0.32
▸ WNT1 P04628 1/20 0.32
▸ CLK2 P49760 1/20 0.32
▸ CLK3 P49761 1/20 0.32

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
SCHEMBL19115601 0.81 MAP2K4 (0.38) MAP2K4MAPK1MAPKAPK2MAPKAPK3MAPK6
SCHEMBL19104287 0.77 MAP2K4 (0.38) MAP2K4MAPK1MAPKAPK2MAPKAPK3MAPK6
SCHEMBL19115954 0.77 JAK2 (0.41) MAP2K4MAPK1MAPKAPK2MAPKAPK3MAPK6
SCHEMBL19115759 0.76 PDPK1 (0.42) JAK2KDM4EDYRK1ANTRK1CLK2
SCHEMBL22349087 0.76 MAPK1 (0.36) MAP2K4MAPK1MAPKAPK2MAPKAPK3MAPK6
SCHEMBL23588974 0.76 CYP1A2 (0.33) MAP2K4MAPK1MAPKAPK2MAPK6DYRK1A
SCHEMBL2723270 0.75 MAP2K4 (0.49) MAP2K4MAPK1MAPKAPK2MAPK6CTNNB1
SCHEMBL4777030 0.75 MAP2K4 (0.41) MAP2K4MAPK1JAK1TYK2JAK3
SCHEMBL25724392 0.74 MAPK1 (0.44) MAPK1JAK2TYK2JAK3TLR8
SCHEMBL22924137 0.73 GAA (0.32) MAP2K4MAPK1MAPKAPK2MAPK6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025918-A1 KRAS G12D Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-01-25 — — US disclosed
US-20230203060-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2023-06-29 — — US disclosed
US-20230203060-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2023-06-29 — — 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 (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-20230203060-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF KRAS, NRAS, TP53 MAP2K4 812/4885MAPK1 577/4885MAPKAPK2 1060/4885
US-20240025918-A1 KRAS G12D Inhibitors KRAS, NRAS, HRAS MAP2K4 2815/4885MAPK1 445/4885MAPKAPK2 574/4885

“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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