SCHEMBL26686460

SCHEMBL26686460

Clc1ccnc2[nH]c(CCCC3CCNCC3)cc12

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.44
▸ CDK9 P50750 12/20 0.42
▸ CDC7 O00311 1/20 0.42
▸ PIM1 P11309 1/20 0.42
▸ CCNT1 O60563 10/20 0.41
▸ SLC6A4 P31645 2/20 0.38
▸ NAMPT P43490 1/20 0.38
▸ NMT1 P30419 1/20 0.37
▸ FAAH O00519 1/20 0.37
▸ CCNK O75909 1/20 0.37
▸ CDK12 Q9NYV4 1/20 0.37
▸ BRD4 O60885 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
SCHEMBL26686419 0.93 CDK9 (0.44) HRH3CDK9CDC7PIM1CCNT1
SCHEMBL26686430 0.87 CDK9 (0.37) CDK9CDC7PIM1CCNT1CCNK
SCHEMBL26686782 0.85 CDK9 (0.45) HRH3CDK9CDC7PIM1CCNT1
SCHEMBL26686140 0.81 DAO (0.39) CDK9CDC7PIM1CCNKCDK12
SCHEMBL26686492 0.73 KDM5B (0.46) CDK9CDC7PIM1
SCHEMBL25427476 0.72 CDK9 (0.63) CDK9CCNT1
SCHEMBL31380026 0.72 CDK9 (0.63) CDK9CCNT1
SCHEMBL26889438 0.72 HRH3 (0.44) HRH3CDK9CDC7PIM1
SCHEMBL26686463 0.71 CDK9 (0.42) CDK9CDC7PIM1CCNT1CCNK
SCHEMBL20839836 0.70 CCNK (0.40) CCNKCDK12

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 4 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

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 HRH3 3648/4885CDK9 98/4885CDC7 436/4885

“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