SCHEMBL31247458

SCHEMBL31247458

CS(=O)(=O)c1cccnc1Nc1cc(Nc2ncccc2F)ncn1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 8/20 0.46
▸ JAK1 P23458 2/20 0.43
▸ TYK2 P29597 2/20 0.43
▸ GRM4 Q14833 2/20 0.41
▸ TNNI3K Q59H18 4/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ LMNA P02545 2/20 0.38
▸ AR P10275 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ EGFR P00533 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
SCHEMBL31247372 0.84 CDK1 (0.46) GCKJAK1TYK2GRM4TNNI3K
SCHEMBL31300245 0.84 CDK1 (0.46) GCKJAK1TYK2GRM4TNNI3K
SCHEMBL31247520 0.80 GRM5 (0.54) GCKJAK1TYK2TNNI3KHPGD
SCHEMBL25242188 0.79 TYK2 (0.45) JAK1TYK2TNNI3K
SCHEMBL31247496 0.79 GRM5 (0.52) GCKTYK2TNNI3KLMNAAR
SCHEMBL31247704 0.76 JAK1 (0.40) GCKJAK1TYK2GRM4LMNA
SCHEMBL31247474 0.76 TYK2 (0.43) GCKJAK1TYK2TNNI3KJAK2
SCHEMBL31247362 0.75 TYK2 (0.41) GCKJAK1TYK2TNNI3KJAK2
SCHEMBL31247547 0.75 BRAF (0.40) GCKJAK1TYK2TNNI3KJAK2
SCHEMBL31247522 0.75 JAK1 (0.41) GCKJAK1TYK2TNNI3KJAK2

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 GCK 438/4885JAK1 9/4885TYK2 1/4885
US-20240425484-A1 INHIBITORS OF TYK2 TYK2, LCK, JAK2 GCK 837/4885JAK1 5/4885TYK2 1/4885

“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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