SCHEMBL30366541

SCHEMBL30366541

CC(=O)N1c2ccc(-c3ccc(C(C)(C)NC(=O)OC(C)(C)C)cc3)cc2CC[C@@H]1C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 3/20 0.41
▸ BRD2 P25440 3/20 0.41
▸ BRD3 Q15059 3/20 0.41
▸ PDK1 Q15118 11/20 0.40
▸ PDK2 Q15119 11/20 0.40
▸ PDK3 Q15120 11/20 0.40
▸ PDK4 Q16654 11/20 0.40
▸ ALDH1A1 P00352 4/20 0.39
▸ HTT P42858 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TSHR P16473 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ NOTUM Q6P988 1/20 0.37

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
SCHEMBL18871818 0.83 CD274 (0.42) BRD4BRD2BRD3PDK1PDK2
SCHEMBL30366640 0.81 ALDH1A1 (0.46) BRD4BRD2BRD3PDK1PDK2
SCHEMBL27265643 0.81 CD274 (0.40) BRD4BRD2BRD3PDK1PDK2
SCHEMBL26079016 0.80 WDR5 (0.45) BRD4BRD2BRD3PDK1PDK2
SCHEMBL18871766 0.79 LMNA (0.39) BRD4BRD2BRD3PDK1PDK2
SCHEMBL26079727 0.79 KMT2A (0.42) BRD4BRD2BRD3PDK1PDK2
SCHEMBL26079791 0.77 ALDH1A1 (0.44) BRD4PDK1PDK2PDK3PDK4
SCHEMBL14756175 0.76 BRD4 (0.56) BRD4BRD2BRD3PDK1PDK2
SCHEMBL30366353 0.76 PDK1 (0.48) PDK1PDK2PDK3PDK4ALDH1A1
SCHEMBL26071914 0.76 CYP11B1 (0.47) BRD4BRD2BRD3PDK1PDK2

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-20230312577-A1 DUAL KINASE-BROMODOMAIN INHIBITORS MONASH UNIVERSITY (AU) 2023-10-05 — — US disclosed
EP-4165045-A1 DUAL KINASE-BROMODOMAIN INHIBITORS Monash University (AU) 2023-04-19 — — EP 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-20230312577-A1 DUAL KINASE-BROMODOMAIN INHIBITORS MAP2K2, BRPF3, BRDT BRD4 10/4885BRD2 8/4885BRD3 4/4885

“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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