SCHEMBL31247617

SCHEMBL31247617

Cc1ccnc(Nc2cc(Nc3ccccc3C#N)ncn2)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 2/20 0.57
▸ CDK4 P11802 1/20 0.43
▸ CDK2 P24941 1/20 0.43
▸ LRRK2 Q5S007 2/20 0.42
▸ NPC1 O15118 3/20 0.41
▸ PKM P14618 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ EPHB4 P54760 1/20 0.41
▸ TP53 P04637 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ MAPK10 P53779 1/20 0.38
▸ EGFR P00533 1/20 0.38
▸ IRAK4 Q9NWZ3 1/20 0.38
▸ SCN9A Q15858 1/20 0.38
▸ TTK P33981 1/20 0.38
▸ SLC2A1 P11166 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ FLT1 P17948 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
SCHEMBL31247692 0.82 AURKA (0.47) AURKALRRK2NPC1RAB9ASMN1; SMN2
SCHEMBL31247588 0.81 AURKA (0.55) AURKACDK4CDK2LRRK2EPHB4
SCHEMBL31247548 0.81 AURKA (0.48) AURKALRRK2NPC1RAB9AMAPK10
SCHEMBL31247770 0.78 AURKA (0.43) AURKALRRK2TP53IRAK4TTK
SCHEMBL31247594 0.77 AURKA (0.43) AURKALRRK2NPC1RAB9ASMN1; SMN2
SCHEMBL31247657 0.76 AURKA (0.59) AURKACDK2MAPK10IRAK4L3MBTL1
SCHEMBL31247399 0.74 AURKA (0.48) AURKACDK2LRRK2SMN1; SMN2LMNA
SCHEMBL31247430 0.73 AURKA (0.40) AURKALRRK2NPC1RAB9AMAPK10
SCHEMBL31247412 0.72 LRRK2 (0.47) AURKALRRK2IRAK4
SCHEMBL1182506 0.71 AURKA (0.61) AURKACDK4CDK2LRRK2NPC1

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 150/4885CDK4 751/4885CDK2 151/4885
US-20260048051-A1 TREATMENT OF INFLAMMATORY BOWEL DISEASE TYK2, FRK, DYRK2 AURKA 1353/4885CDK4 1218/4885CDK2 571/4885
US-12358904-B2 Inhibitors of TYK2 TYK2, LCK, JAK2 AURKA 150/4885CDK4 751/4885CDK2 151/4885
US-20240425484-A1 INHIBITORS OF TYK2 TYK2, LCK, JAK2 AURKA 150/4885CDK4 751/4885CDK2 151/4885

“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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