SCHEMBL26686398

SCHEMBL26686398

Nc1n[nH]c2c(Cl)cc(-c3ccnc4[nH]c(C(=O)NCCN5CCCCC5)cc34)cc12

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 3/20 0.44
▸ AURKB Q96GD4 3/20 0.44
▸ NUDT1 P36639 4/20 0.44
▸ WNT1 P04628 4/20 0.44
▸ DYRK1A Q13627 4/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ RHEB Q15382 1/20 0.43
▸ PARP1 P09874 1/20 0.41
▸ SYK P43405 1/20 0.40
▸ APP P05067 1/20 0.40

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
SCHEMBL30633364 1.00 AURKA (0.44) AURKAAURKBNUDT1WNT1DYRK1A
SCHEMBL26686261 0.85 DYRK1A (0.56) AURKAAURKBNUDT1WNT1DYRK1A
SCHEMBL30633374 0.85 DYRK1A (0.56) AURKAAURKBNUDT1WNT1DYRK1A
SCHEMBL26686587 0.81 KDM4E (0.55) WNT1DYRK1AKDM4EHSD17B10RHEB
SCHEMBL30633400 0.81 KDM4E (0.55) WNT1DYRK1AKDM4EHSD17B10RHEB
SCHEMBL26686734 0.74 CCNK (0.44) AURKAAURKB
SCHEMBL31240454 0.74 DYRK1A (0.54) WNT1DYRK1APARP1APP
SCHEMBL31240468 0.72 CCNK (0.52) NUDT1
SCHEMBL26686752 0.72 CCNK (0.52) NUDT1
SCHEMBL31240736 0.72 NUDT1 (0.49) NUDT1WNT1DYRK1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304576-A1 IKK INHIBITORS CANCER RESEARCH TECH LTD (GB) 2025-10-02 — — US disclosed
WO-2023218201-A1 IKK INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-11-16 — — 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 (1 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-20250304576-A1 IKK INHIBITORS NFKBIA, IKBKE, IKBKB AURKA 269/4885AURKB 161/4885NUDT1 3400/4885

“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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