SCHEMBL31247548

SCHEMBL31247548

Cc1ccnc(Nc2cc(Nc3ccccc3C#N)ncn2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 2/20 0.48
▸ MAPK10 P53779 2/20 0.43
▸ KDR P35968 3/20 0.43
▸ MAP4K4 O95819 1/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ LCK P06239 1/20 0.43
▸ FYN P06241 1/20 0.43
▸ IGF1R P08069 1/20 0.43
▸ LTK P29376 1/20 0.43
▸ MAP2K2 P36507 1/20 0.43
▸ MAPK8 P45983 1/20 0.43
▸ MAPK9 P45984 1/20 0.43
▸ CLK2 P49760 1/20 0.43
▸ GSK3A P49840 1/20 0.43
▸ GSK3B P49841 1/20 0.43
▸ CDK7 P50613 1/20 0.43
▸ CDK9 P50750 1/20 0.43
▸ CDK5 Q00535 1/20 0.43
▸ MAP2K1 Q02750 1/20 0.43
▸ ACVR1 Q04771 1/20 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
SCHEMBL31247588 0.85 AURKA (0.55) AURKAMAPK10KDRLRRK2JAK2
SCHEMBL31247430 0.84 AURKA (0.40) AURKAMAPK10KDRLRRK2ALDH1A1
SCHEMBL31247617 0.81 AURKA (0.57) AURKAMAPK10KDRLRRK2NPC1
SCHEMBL31247692 0.81 AURKA (0.47) AURKAKDRMAP4K4GSK3BLRRK2
SCHEMBL31247594 0.80 AURKA (0.43) AURKAMAPK10KDRLRRK2ALDH1A1
SCHEMBL31247770 0.79 AURKA (0.43) AURKAKDRLRRK2KDM4EMEN1
SCHEMBL31247399 0.77 AURKA (0.48) AURKAMAPK10KDRCDK5LRRK2
SCHEMBL31247412 0.77 LRRK2 (0.47) AURKALRRK2
SCHEMBL31247722 0.75 TYK2 (0.63) MAPK10KDRMAP4K4ABL1LCK
SCHEMBL31247590 0.75 MAPK10 (0.43) MAPK10KDRMAP4K4ABL1LCK

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 AURKA 150/4885MAPK10 309/4885KDR 1792/4885
US-20260048051-A1 TREATMENT OF INFLAMMATORY BOWEL DISEASE TYK2, FRK, DYRK2 AURKA 1353/4885MAPK10 480/4885KDR 1579/4885
US-12358904-B2 Inhibitors of TYK2 TYK2, LCK, JAK2 AURKA 150/4885MAPK10 309/4885KDR 1792/4885
US-20240425484-A1 INHIBITORS OF TYK2 TYK2, LCK, JAK2 AURKA 150/4885MAPK10 309/4885KDR 1792/4885

“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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