SCHEMBL26686016

SCHEMBL26686016

CC(C)(C)C#Cc1cc(-c2ccnc3[nH]c(C4CC4)cc23)cc2c(N)n[nH]c12

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 4/20 0.44
▸ CHUK O15111 4/20 0.44
▸ TBK1 Q9UHD2 1/20 0.43
▸ CYP2C9 P11712 1/20 0.41
▸ CIT O14578 1/20 0.41
▸ CDK9 P50750 14/20 0.40
▸ CCNT1 O60563 12/20 0.40
▸ CASP3 P42574 2/20 0.39
▸ CASP7 P55210 2/20 0.39

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
SCHEMBL26686245 0.96 CDK9 (0.42) IKBKBCHUKTBK1CYP2C9CIT
SCHEMBL26686177 0.85 IKBKB (0.42) IKBKBCHUKTBK1CIT
SCHEMBL30633151 0.83 CHUK (0.37) IKBKBCHUKTBK1CIT
SCHEMBL26685805 0.83 CHUK (0.37) IKBKBCHUKTBK1CIT
SCHEMBL26686660 0.83 KDM5B (0.33) IKBKBCHUKTBK1
SCHEMBL26685815 0.82 NUDT1 (0.44) IKBKBCHUKCIT
SCHEMBL30633136 0.82 NUDT1 (0.44) IKBKBCHUKCIT
SCHEMBL26686186 0.81 BRD4 (0.43) IKBKBCHUKCITCDK9
SCHEMBL31420163 0.81 BRD4 (0.43) IKBKBCHUKCITCDK9
SCHEMBL26685886 0.80 CCNT1 (0.31) CDK9CCNT1

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 9 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 claimed
EP-4522597-A1 IKK INHIBITORS Cancer Research Technology Limited (GB) 2025-03-19 — — EP claimed
CN-119562945-A IKK inhibitors 癌症研究技术有限公司 2025-03-04 — — CN claimed
WO-2023218201-A1 IKK INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2023-11-16 — — WO claimed
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 IKBKB 3/4885CHUK 6/4885TBK1 11/4885

“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.

Send feedback