SCHEMBL31247468

SCHEMBL31247468

Cc1cccc(Nc2cc(Nc3ccccc3NS(C)(=O)=O)ncn2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ BACE1 P56817 4/20 0.46
▸ PTK2 Q05397 3/20 0.46
▸ GLO1 Q04760 1/20 0.46
▸ HSD11B1 P28845 2/20 0.45
▸ TNNI3K Q59H18 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ CLK4 Q9HAZ1 1/20 0.44
▸ JAK2 O60674 2/20 0.43
▸ JAK1 P23458 2/20 0.43
▸ TYK2 P29597 2/20 0.43

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
SCHEMBL31247652 0.81 GRM5 (0.45) KDM4EALDH1A1HPGDHSD17B10HSD11B1
SCHEMBL31247691 0.76 TNNI3K (0.42) KDM4EALDH1A1HPGDHSD17B10HSD11B1
SCHEMBL31247692 0.76 AURKA (0.47) BACE1JAK2JAK1TYK2JAK3
SCHEMBL12017942 0.76 ALDH1A1 (0.64) KDM4EALDH1A1HPGDHSD17B10GLO1
SCHEMBL31247510 0.74 TYK2 (0.48) KDM4EALDH1A1HPGDHSD17B10HSD11B1
SCHEMBL31300246 0.73 TYK2 (0.53) KDM4EALDH1A1HPGDHSD17B10HSD11B1
SCHEMBL31247729 0.73 GRM5 (0.54) ALDH1A1JAK2JAK1TYK2JAK3
SCHEMBL31247663 0.73 JAK2 (0.52) JAK2JAK1TYK2JAK3MAP4K4
SCHEMBL31300242 0.72 HTT (0.50) JAK2JAK1TYK2JAK3MAP4K4
SCHEMBL31247375 0.72 HTT (0.50) JAK2JAK1TYK2JAK3MAP4K4

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 KDM4E 302/4885ALDH1A1 4785/4885HPGD 4472/4885
US-20260048051-A1 TREATMENT OF INFLAMMATORY BOWEL DISEASE TYK2, FRK, DYRK2 KDM4E 642/4885ALDH1A1 4552/4885HPGD 4439/4885
US-12358904-B2 Inhibitors of TYK2 TYK2, LCK, JAK2 KDM4E 302/4885ALDH1A1 4785/4885HPGD 4472/4885
US-20240425484-A1 INHIBITORS OF TYK2 TYK2, LCK, JAK2 KDM4E 302/4885ALDH1A1 4785/4885HPGD 4472/4885

“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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