SCHEMBL3757879

SCHEMBL3757879

CO[PH](=O)Oc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.76
MEN1 O00255 6/20 0.76
KMT2A Q03164 6/20 0.76
CYP1A1 P04798 5/20 0.76
CYP1B1 Q16678 5/20 0.76
IPMK Q8NFU5 4/20 0.76
IP6K2 Q9UHH9 4/20 0.76
CA12 O43570 3/20 0.76
CA2 P00918 3/20 0.76
PPARG P37231 3/20 0.76
CA7 P43166 3/20 0.76
XDH P47989 3/20 0.76
CA4 P22748 2/20 0.76
BCL9 O00512 8/20 0.63
CTNNB1 P35222 8/20 0.63
ABCB1 P08183 6/20 0.63
KDM4E B2RXH2 4/20 0.63
CYP3A4 P08684 4/20 0.63
HSD17B10 Q99714 4/20 0.63
TP53 P04637 3/20 0.63

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
SCHEMBL19204498 0.88 CYP1A2 (0.73) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL30385934 0.86 MEN1 (1.00) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL29377152 0.86 MEN1 (1.00) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL19235 0.86 MEN1 (1.00) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL29390102 0.86 MEN1 (1.00) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL3715283 0.83 MEN1 (0.93) CYP1A2MEN1KMT2ACYP1A1CYP1B1
Isorhamnetin SCHEMBL28182051 0.83 MEN1 (0.93) CYP1A2MEN1KMT2ACYP1A1CYP1B1
SCHEMBL29575749 0.82 MEN1 (0.86) CYP1A2MEN1KMT2ACYP1A1CYP1B1
SCHEMBL30256517 0.82 MEN1 (0.86) CYP1A2MEN1KMT2ACYP1A1CYP1B1
SCHEMBL3211188 0.82 MEN1 (0.86) CYP1A2MEN1KMT2ACYP1A1CYP1B1

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 1 patent. 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

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 CYP1A2 2311/4885MEN1 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.