SCHEMBL3718645

SCHEMBL3718645

CP(=O)(Oc1ccc(-c2oc3cc(O)ccc3c(=O)c2O)cc1O)Oc1ccc(-c2oc3cc(O)ccc3c(=O)c2O)cc1O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.66
MEN1 O00255 9/20 0.66
KMT2A Q03164 9/20 0.66
KDM4E B2RXH2 9/20 0.66
CYP3A4 P08684 8/20 0.66
HSD17B10 Q99714 8/20 0.66
TP53 P04637 8/20 0.66
CASP1 P29466 6/20 0.66
CASP7 P55210 6/20 0.66
ALDH1A1 P00352 5/20 0.66
HPGD P15428 5/20 0.66
MAPK1 P28482 4/20 0.66
ALOX15 P16050 4/20 0.66
CYP2C9 P11712 4/20 0.66
LMNA P02545 3/20 0.66
RECQL P46063 3/20 0.66
CDK5 Q00535 2/20 0.66
CDK5R1 Q15078 2/20 0.66
XDH P47989 2/20 0.66
ALOX12 P18054 2/20 0.66

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
SCHEMBL13598637 0.90 MEN1 (0.67) MAPTMEN1KMT2AKDM4ECYP3A4
SCHEMBL4101098 0.86 ABCB1 (0.84) MAPTMEN1KMT2AKDM4ECYP3A4
SCHEMBL3807705 0.84 CYP1A2 (0.75) MAPTMEN1KMT2AKDM4ECYP3A4
SCHEMBL13056266 0.82 MAPT (0.63) MAPTMEN1KMT2AKDM4ECYP3A4
SCHEMBL3718642 0.82 MEN1 (0.72) MAPTMEN1KMT2AKDM4ECYP3A4
SCHEMBL119654 0.81 MEN1 (0.74) MAPTMEN1KMT2AKDM4ECYP3A4
Fisetin SCHEMBL4466733 0.81 MEN1 (0.90) MAPTMEN1KMT2AKDM4ECYP3A4
SCHEMBL119655 0.81 MEN1 (0.73) MAPTMEN1KMT2AKDM4ECYP3A4
Fisetin SCHEMBL116861 0.80 MEN1 (1.00) MAPTMEN1KMT2AKDM4ECYP3A4
Fisetin SCHEMBL29381611 0.80 MEN1 (1.00) MAPTMEN1KMT2AKDM4ECYP3A4

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 MAPT 2712/4885MEN1 2302/4885KMT2A 4512/4885

“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.