SCHEMBL3718774

SCHEMBL3718774

CP(=O)(OOc1cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc2c1)OOc1cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.71
▸ KMT2A Q03164 5/20 0.71
▸ KDM4E B2RXH2 3/20 0.71
▸ CYP3A4 P08684 3/20 0.71
▸ RECQL P46063 3/20 0.71
▸ HSD17B10 Q99714 3/20 0.71
▸ IPMK Q8NFU5 3/20 0.71
▸ IP6K2 Q9UHH9 3/20 0.71
▸ LMNA P02545 2/20 0.71
▸ APP P05067 2/20 0.71
▸ MAPT P10636 2/20 0.71
▸ THRB P10828 2/20 0.71
▸ AKR1B1 P15121 2/20 0.71
▸ ELAVL3 Q14576 2/20 0.71
▸ TDP1 Q9NUW8 2/20 0.71
▸ CYP1A2 P05177 5/20 0.65
▸ CYP1A1 P04798 4/20 0.65
▸ CYP1B1 Q16678 4/20 0.65
▸ NOX4 Q9NPH5 3/20 0.65
▸ XDH P47989 3/20 0.65

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
SCHEMBL3718780 0.92 MEN1 (0.70) MEN1KMT2AKDM4ECYP3A4RECQL
SCHEMBL3718781 0.89 MEN1 (0.74) MEN1KMT2AKDM4ECYP3A4RECQL
SCHEMBL27193648 0.86 MEN1 (0.82) MEN1KMT2AKDM4ECYP3A4RECQL
Rhamnetin SCHEMBL7164573 0.83 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4RECQL
Rhamnetin SCHEMBL29496169 0.83 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4RECQL
Rhamnetin SCHEMBL29453025 0.83 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4RECQL
Rhamnetin SCHEMBL555118 0.83 MEN1 (1.00) MEN1KMT2AKDM4ECYP3A4RECQL
SCHEMBL3807697 0.83 CYP1A2 (0.72) MEN1KMT2AKDM4ECYP3A4RECQL
SCHEMBL19469990 0.83 MEN1 (0.72) MEN1KMT2AKDM4ECYP3A4RECQL
SCHEMBL27581494 0.82 MEN1 (0.79) MEN1KMT2AKDM4ECYP3A4RECQL

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-20100297020-A1 PHOSPHORYLATED AND PHOSPHONATED PYRONE ANALOGS FOR THERAPEUTIC TREATMENT LIMERICK BIOPHARMA, INC. (US) 2010-11-25 — — US disclosed
WO-2010129138-A2 PHOSPHORYLATED AND PHOSPHONATED PYRONE ANALOGS FOR THERAPEUTIC TREATMENT LIMERICK BIOPHARMA (US) 2010-11-11 — — 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-20100297020-A1 PHOSPHORYLATED AND PHOSPHONATED PYRONE ANALOGS FOR THERAPEUTIC TREATMENT PC, PCK1, PYGL MEN1 2302/4885KMT2A 4512/4885KDM4E 3745/4885

“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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