SCHEMBL29265374

SCHEMBL29265374

COc1nn(CCCNC(=O)OC(C)(C)C)cc1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 6/20 0.42
▸ BRD4 O60885 4/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ DYRK1A Q13627 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CA12 O43570 2/20 0.37
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ PDPK1 O15530 1/20 0.37
▸ CCNB2 O95067 1/20 0.37
▸ PRKCB P05771 1/20 0.37
▸ CDK1 P06493 1/20 0.37
▸ LYN P07948 1/20 0.37
▸ CCNB1 P14635 1/20 0.37
▸ CCNA2 P20248 1/20 0.37
▸ CDK2 P24941 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
SCHEMBL31376155 0.97 DRD2 (0.43) DRD2BRD4SMN1; SMN2TDP1CA12
SCHEMBL30380364 0.96 DRD2 (0.44) DRD2BRD4SMN1; SMN2TDP1CA12
SCHEMBL29265248 0.96 DRD2 (0.44) DRD2BRD4SMN1; SMN2TDP1CA12
SCHEMBL29265250 0.96 DRD2 (0.44) DRD2BRD4SMN1; SMN2TDP1CA12
SCHEMBL30380512 0.93 DRD2 (0.51) DRD2SMN1; SMN2KMT2A
SCHEMBL25405883 0.83 BRD4 (0.43) DRD2BRD4TDP1CA12CA1
SCHEMBL30379805 0.83 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1
SCHEMBL25014613 0.83 DRD2 (0.46) DRD2BRD4DYRK1ATDP1CA12
SCHEMBL29265376 0.82 TDP1 (0.43) DRD2BRD4TDP1CA12CA1
SCHEMBL29265249 0.79 BRD4 (0.42) DRD2BRD4TDP1CA12CA1

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-20250057997-A1 CONJUGATES COMPRISING COVALENT BINDERS FOR TARGETING INTRACELLULAR PROTEINS RAYZEBIO, INC. 2025-02-20 — — US disclosed
EP-4380937-A1 CONJUGATES COMPRISING COVALENT BINDERS FOR TARGETING INTRACELLULAR PROTEINS Rayzebio, Inc. (US) 2024-06-12 — — EP disclosed
CN-118176194-A Conjugates comprising covalent binding agents for targeting intracellular proteins 瑞择生物公司 2024-06-11 — — CN disclosed
WO-2023059583-A1 HETEROBIFUNCTIONAL COMPOUNDS AND THEIR USE IN TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2023-04-13 — — WO disclosed
WO-2023014988-A1 CONJUGATES COMPRISING COVALENT BINDERS FOR TARGETING INTRACELLULAR PROTEINS RAYZEBIO, INC. (US) 2023-02-09 — — 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-20250057997-A1 CONJUGATES COMPRISING COVALENT BINDERS FOR TARGETING INTRACELLULAR PROTEINS CD2BP2, TP53, CAB39 DRD2 4562/4885BRD4 1450/4885SMN1; SMN2 3309/4885

“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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