SCHEMBL31247520

SCHEMBL31247520

Cc1cccc(Nc2cc(Nc3ncccc3S(C)(=O)=O)ncn2)n1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 11/20 0.54
▸ ASIC3 Q9UHC3 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ HTT P42858 1/20 0.42
▸ HSD11B1 P28845 1/20 0.41
▸ JAK1 P23458 1/20 0.40
▸ TYK2 P29597 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ GCK P35557 1/20 0.39
▸ EGFR P00533 1/20 0.39
▸ ERBB3 P21860 1/20 0.39
▸ TNNI3K Q59H18 1/20 0.39

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
SCHEMBL25242188 0.85 TYK2 (0.45) GRM5MAPTJAK1TYK2TNNI3K
SCHEMBL31247496 0.84 GRM5 (0.52) GRM5TYK2GCKEGFRTNNI3K
SCHEMBL31247813 0.83 GRM5 (0.58) GRM5ASIC3MAPTHTTKDM4E
SCHEMBL31247652 0.81 GRM5 (0.45) GRM5ASIC3MAPTHTTHSD11B1
SCHEMBL31247458 0.80 GCK (0.46) HTTJAK1TYK2HPGDGCK
SCHEMBL31247774 0.80 GRM5 (0.84) GRM5ASIC3HTTEGFRERBB3
SCHEMBL31247767 0.80 GRM5 (0.53) GRM5ASIC3MAPTHTTJAK1
SCHEMBL31247372 0.80 CDK1 (0.46) HTTJAK1TYK2KDM4EALDH1A1
SCHEMBL31300245 0.80 CDK1 (0.46) HTTJAK1TYK2KDM4EALDH1A1
SCHEMBL31247691 0.79 TNNI3K (0.42) GRM5MAPTHTTHSD11B1JAK1

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 GRM5 1437/4885ASIC3 2671/4885MAPT 3432/4885
US-20240425484-A1 INHIBITORS OF TYK2 TYK2, LCK, JAK2 GRM5 2396/4885ASIC3 2980/4885MAPT 1028/4885

“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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