SCHEMBL26686252

SCHEMBL26686252

Nc1nccc(Cl)c1C#CCCCCl

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.35
PTPN11 Q06124 1/20 0.35
TLR7 Q9NYK1 2/20 0.33
NOS2 P35228 2/20 0.32
NOS3 P29474 1/20 0.32

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
SCHEMBL26887037 0.88 TLR7 (0.46) TLR7NOS2NOS3
SCHEMBL30731229 0.84 PTPN1 (0.35) PTPN1PTPN11TLR7
SCHEMBL26887029 0.84 TLR7 (0.43) TLR7NOS2NOS3
SCHEMBL26686605 0.80 AHCY (0.40) TLR7NOS2NOS3
SCHEMBL26887143 0.80 HRH3 (0.40)
SCHEMBL26686455 0.79 NOS2 (0.32) NOS2NOS3
SCHEMBL26686424 0.78 EGFR (0.40)
SCHEMBL26686590 0.77 OPRL1 (0.38)
SCHEMBL26686308 0.76 DHFR (0.47) TLR7NOS2NOS3
SCHEMBL26686282 0.76 HRH3 (0.47)

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 5 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
EP-4522597-A1 IKK INHIBITORS Cancer Research Technology Limited (GB) 2025-03-19 EP disclosed
CN-119562945-A IKK inhibitors 癌症研究技术有限公司 2025-03-04 CN disclosed
WO-2023218201-A1 IKK INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-11-16 WO 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 PTPN1 806/4885PTPN11 1111/4885TLR7 1811/4885

“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.