SCHEMBL31247799

SCHEMBL31247799

COc1cnc(Nc2cc(N)ncn2)c(S(C)(=O)=O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 1/20 0.40
▸ CCNB1 P14635 1/20 0.40
▸ CCNA2 P20248 1/20 0.40
▸ CCNE1 P24864 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ CDK5 Q00535 1/20 0.40
▸ CDK5R1 Q15078 1/20 0.40
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ EGFR P00533 4/20 0.38
▸ ERBB3 P21860 2/20 0.38
▸ JAK2 O60674 1/20 0.36
▸ KIT P10721 1/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ TYK2 P29597 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ ALPL P05186 1/20 0.36
▸ SCN9A Q15858 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ MTOR P42345 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
SCHEMBL31247445 0.82 TNNI3K (0.42) CDK1CCNB1CCNA2CCNE1CDK2
SCHEMBL31247667 0.82 CDK1 (0.42) CDK1CCNB1CCNA2CCNE1CDK2
SCHEMBL31247578 0.76 MEN1 (0.40) CDK1CCNB1CCNA2CCNE1CDK2
SCHEMBL24588117 0.76 LRRK2 (0.41) MEN1KMT2AJAK2KITJAK1
SCHEMBL31247713 0.75 CDK1 (0.36) CDK1CCNB1CCNA2CCNE1CDK2
SCHEMBL31247372 0.75 CDK1 (0.46) CDK1CCNB1CCNA2CCNE1CDK2
SCHEMBL31300245 0.75 CDK1 (0.46) CDK1CCNB1CCNA2CCNE1CDK2
SCHEMBL24588294 0.72 LRRK2 (0.42) JAK2KITJAK1TYK2KCNH2
SCHEMBL31247612 0.71 CDK1 (0.42) CDK1CCNB1CCNA2CCNE1CDK2
SCHEMBL31300236 0.69 CDK1 (0.48) CDK1CCNB1CCNA2CCNE1CDK2

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
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-20240425484-A1 INHIBITORS OF TYK2 Atomwise Inc. 2024-12-26 — — 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 (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-20260048051-A1 TREATMENT OF INFLAMMATORY BOWEL DISEASE TYK2, FRK, DYRK2 CDK1 699/4885CCNB1 2851/4885CCNA2 2586/4885
US-20240425484-A1 INHIBITORS OF TYK2 TYK2, LCK, JAK2 CDK1 423/4885CCNB1 2570/4885CCNA2 1887/4885

“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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