SCHEMBL25032479

SCHEMBL25032479

CC(C)(C)OC(=O)Nc1ccc(P(C)(C)=O)c2c1OCCO2

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PSMB8 P28062 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ METAP1 P53582 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ BRD9 Q9H8M2 1/20 0.33
▸ CYP17A1 P05093 1/20 0.33
▸ AAK1 Q2M2I8 1/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ NAMPT P43490 1/20 0.32
▸ PRKDC P78527 1/20 0.32
▸ KCNQ4 P56696 1/20 0.32
▸ KCNQ5 Q9NR82 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.32

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
SCHEMBL25033142 0.92 PSMB8 (0.34) PSMB8RXFP1METAP1CD274BRD9
SCHEMBL31304930 0.86 RXFP1 (0.33) PSMB8RXFP1METAP1CD274BRD9
SCHEMBL25907603 0.80 CYP17A1 (0.37) PSMB8RXFP1METAP1CD274BRD9
SCHEMBL31270434 0.80 RXFP1 (0.35) PSMB8RXFP1METAP1BRD9CYP17A1
SCHEMBL23832624 0.79 KDM4E (0.38) PSMB8RXFP1METAP1BRD9CYP17A1
SCHEMBL7949833 0.75 MRGPRX1 (0.46) RXFP1BRD9
SCHEMBL30317135 0.75 MRGPRX1 (0.46) RXFP1BRD9
SCHEMBL31304836 0.73 NPC1 (0.34) PSMB8RXFP1METAP1CYP17A1CA12
SCHEMBL26148249 0.73 CA12 (0.40) PSMB8BRD9CYP17A1CA12CA1
SCHEMBL24819174 0.72 AAK1 (0.37) PSMB8BRD9CYP17A1AAK1CA12

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-20240400591-A1 COMPOUNDS TARGETING MUTANT OF P53 JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-12-05 — — US disclosed
WO-2023016434-A1 COMPOUNDS TARGETING MUTANT OF P53 JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-02-16 — — 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-20240400591-A1 COMPOUNDS TARGETING MUTANT OF P53 TP53, TP53BP1, MDM2 PSMB8 1717/4885RXFP1 4730/4885METAP1 2758/4885

“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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