SCHEMBL31247717

SCHEMBL31247717

Cc1cccc(Nc2cc(Nc3cnccc3C#N)ncn2)n1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 11/20 0.44
▸ SYK P43405 3/20 0.40
▸ AURKA O14965 1/20 0.39
▸ KARS1 Q15046 1/20 0.37
▸ JAK2 O60674 1/20 0.37
▸ MAP4K4 O95819 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ TYK2 P29597 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ IRAK4 Q9NWZ3 1/20 0.36

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
SCHEMBL31247586 0.91 GRM5 (0.44) GRM5SYKAURKAKARS1JAK2
SCHEMBL31247692 0.85 AURKA (0.47) GRM5SYKAURKAJAK2MAP4K4
SCHEMBL31247576 0.79 GRM5 (0.55) GRM5
SCHEMBL31247703 0.79 GRM5 (0.48) GRM5SYKJAK2MAP4K4JAK1
SCHEMBL31247714 0.77 JAK2 (0.54) SYKJAK2MAP4K4JAK1TYK2
SCHEMBL31247770 0.76 AURKA (0.43) GRM5SYKAURKAJAK2JAK1
SCHEMBL31247691 0.76 TNNI3K (0.42) GRM5SYKKARS1JAK2MAP4K4
SCHEMBL31247541 0.75 JAK2 (0.57) SYKJAK2MAP4K4JAK1TYK2
SCHEMBL15679618 0.73 SYK (0.46) GRM5SYK
SCHEMBL31247670 0.72 SYK (0.48) GRM5SYKAURKAJAK2MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4719394-A2 INHIBITORS OF TYK2 Atomwise Inc. (US) 2026-04-08 — — EP disclosed
US-20260048051-A1 TREATMENT OF INFLAMMATORY BOWEL DISEASE ATOMWISE INC (US) 2026-02-19 — — US disclosed
US-12358904-B2 Inhibitors of TYK2 Atomwise Inc. (US) 2025-07-15 — — US disclosed
US-20240425484-A1 INHIBITORS OF TYK2 Atomwise Inc. 2024-12-26 — — US disclosed
US-20240417396-A1 INHIBITORS OF TYK2 Atomwise Inc. 2024-12-19 — — US disclosed
WO-2024250010-A2 INHIBITORS OF TYK2 Atomwise Inc. (US) 2024-12-05 — — WO 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 (4 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-20240417396-A1 INHIBITORS OF TYK2 TYK2, LCK, JAK2 GRM5 2396/4885SYK 11/4885AURKA 150/4885
US-20260048051-A1 TREATMENT OF INFLAMMATORY BOWEL DISEASE TYK2, FRK, DYRK2 GRM5 1437/4885SYK 33/4885AURKA 1353/4885
US-12358904-B2 Inhibitors of TYK2 TYK2, LCK, JAK2 GRM5 2396/4885SYK 11/4885AURKA 150/4885
US-20240425484-A1 INHIBITORS OF TYK2 TYK2, LCK, JAK2 GRM5 2396/4885SYK 11/4885AURKA 150/4885

“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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