SCHEMBL22833754

SCHEMBL22833754

COC(=O)CN1C(=O)COCC1C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.36
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TP53 P04637 1/20 0.33
MDM2 Q00987 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
P2RX7 Q99572 2/20 0.32
PPARG P37231 1/20 0.32
KAT2B Q92831 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL22854580 0.81 PLK1 (0.36) SMN1; SMN2P2RX7GAA
SCHEMBL22854583 0.81 SIGMAR1 (0.41) KDM4ESMN1; SMN2GAA
SCHEMBL9831208 0.76 TP53 (0.45) BRD4KDM4ESMN1; SMN2TP53MDM2
SCHEMBL23328829 0.70 PIK3CD (0.45)
SCHEMBL16317737 0.69 BRD4 (0.41) BRD4KDM4ESMN1; SMN2TP53MDM2
SCHEMBL24879866 0.68 SMN1; SMN2 (0.41) BRD4KDM4ESMN1; SMN2TP53ALDH1A1
SCHEMBL697331 0.68 HCRTR1 (0.52) SMN1; SMN2ALDH1A1HCRTR1HCRTR2KMT2A
SCHEMBL9654559 0.67 GBA1 (0.41) TP53ALDH1A1GAA
SCHEMBL1457777 0.66 USP2 (0.47) TP53ALDH1A1HCRTR1HCRTR2LMNA
SCHEMBL23123714 0.66 NAAA (0.32)

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-20230014226-A1 NEW COMPOUNDS AND METHODS BENEVOLENTAI BIO LIMITED (GB) 2023-01-19 US disclosed
EP-3986559-A1 NEW COMPOUNDS AND METHODS BenevolentAI Bio Limited (GB) 2022-04-27 EP disclosed
CN-114340734-A Novel compounds and methods 博善人工智能生物科技有限公司 2022-04-12 CN disclosed
WO-2020260871-A1 NEW COMPOUNDS AND METHODS BENEVOLENTAI BIO LIMITED (GB) 2020-12-30 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-20230014226-A1 NEW COMPOUNDS AND METHODS ABL2, ABL1, ALK BRD4 4653/4885KDM4E 3546/4885SMN1; SMN2 2246/4885

“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.