SCHEMBL12378873

SCHEMBL12378873

Cc1ccc(-c2oc3cc(O)ccc3c(=O)c2O)cc1C

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.74
▸ KMT2A Q03164 9/20 0.74
▸ CYP3A4 P08684 9/20 0.74
▸ HSD17B10 Q99714 9/20 0.74
▸ KDM4E B2RXH2 8/20 0.74
▸ ALDH1A1 P00352 8/20 0.74
▸ MAPT P10636 7/20 0.74
▸ HPGD P15428 7/20 0.74
▸ CASP1 P29466 6/20 0.74
▸ CASP7 P55210 6/20 0.74
▸ CYP2C9 P11712 6/20 0.74
▸ TP53 P04637 5/20 0.74
▸ MAPK1 P28482 4/20 0.74
▸ CYP2C19 P33261 3/20 0.74
▸ CYP2D6 P10635 2/20 0.74
▸ ALOX15 P16050 4/20 0.71
▸ LMNA P02545 4/20 0.71
▸ CDK5 Q00535 2/20 0.71
▸ CDK5R1 Q15078 2/20 0.71
▸ RECQL P46063 2/20 0.71

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
SCHEMBL25809583 0.90 MEN1 (0.78) MEN1KMT2ACYP3A4HSD17B10KDM4E
SCHEMBL10037940 0.90 MEN1 (0.78) MEN1KMT2ACYP3A4HSD17B10KDM4E
SCHEMBL13056258 0.89 ALDH1A1 (0.71) MEN1KMT2ACYP3A4HSD17B10KDM4E
SCHEMBL13248718 0.86 MEN1 (0.83) MEN1KMT2ACYP3A4HSD17B10KDM4E
Resokaempferol SCHEMBL30873045 0.85 MEN1 (1.00) MEN1KMT2ACYP3A4HSD17B10KDM4E
Resokaempferol SCHEMBL344710 0.85 MEN1 (1.00) MEN1KMT2ACYP3A4HSD17B10KDM4E
SCHEMBL19213535 0.85 MEN1 (0.82) MEN1KMT2ACYP3A4HSD17B10KDM4E
SCHEMBL25209431 0.84 MAPT (0.57) MEN1KMT2ACYP3A4HSD17B10KDM4E
SCHEMBL7457890 0.84 TP53 (0.72) MEN1KMT2ACYP3A4HSD17B10KDM4E
Fisetin SCHEMBL29394036 0.83 MEN1 (1.00) MEN1KMT2ACYP3A4HSD17B10KDM4E

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110190514-A1 PYRONE ANALOG COMPOSITIONS AND METHODS LIMERICK BIOPHARMA, INC. (US) 2011-08-04 — — US disclosed
US-7947733-B2 Phosphorylated pyrone analogs and methods LIMERICK BIOPHARMA (US) 2011-05-24 — — US disclosed
US-20110028437-A1 PHOSPHORYLATED PYRONE ANALOGS AND METHODS LIMERICK BIOPHARMA, INC. (US) 2011-02-03 — — US disclosed
US-20100297020-A1 PHOSPHORYLATED AND PHOSPHONATED PYRONE ANALOGS FOR THERAPEUTIC TREATMENT LIMERICK BIOPHARMA, INC. (US) 2010-11-25 — — US disclosed
US-20100204089-A1 PHOSPHORYLATED PYRONE ANALOGS AND METHODS LIMERICK BIOPHARMA, INC. 2010-08-12 — — US disclosed
US-20100189653-A1 Pyrone analogs for therapeutic treatment LIMERICK BIOPHARMA, INC. 2010-07-29 — — US disclosed
US-20100144612-A1 PHOSPHORYLATED PYRONE ANALOGS AND METHODS LIMERICK BIOPHARMA, INC. 2010-06-10 — — US disclosed
US-20090325906-A1 Methods and compositions for therapeutic treatment LIMERICK BIOPHARMA, INC. 2009-12-31 — — US disclosed
US-20090258939-A1 PYRONE ANALOG COMPOSITIONS AND METHODS LIMERICK BIOPHARMA, INC. 2009-10-15 — — US disclosed
US-20090082400-A1 SOLUBLE PYRONE ANALOGS METHODS AND COMPOSITIONS LIMERICK BIOPHARMA, INC. 2009-03-26 — — US disclosed
US-20090069273-A1 PHOSPHORYLATED PYRONE ANALOGS AND METHODS LIMERICK BIOPHARMA, INC. 2009-03-12 — — 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 (10 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-20090069273-A1 PHOSPHORYLATED PYRONE ANALOGS AND METHODS PCK1, PC, PCK2 MEN1 4072/4885KMT2A 3401/4885CYP3A4 708/4885
US-20090258939-A1 PYRONE ANALOG COMPOSITIONS AND METHODS CYP11B2, CYP11B1, GLS2 MEN1 535/4885KMT2A 4673/4885CYP3A4 718/4885
US-20090325906-A1 Methods and compositions for therapeutic treatment SLC2A1, SLC2A2, SLC2A3 MEN1 4409/4885KMT2A 4599/4885CYP3A4 3140/4885
US-20100297020-A1 PHOSPHORYLATED AND PHOSPHONATED PYRONE ANALOGS FOR THERAPEUTIC TREATMENT PC, PCK1, PYGL MEN1 2302/4885KMT2A 4512/4885CYP3A4 2300/4885
US-20100189653-A1 Pyrone analogs for therapeutic treatment PC, GLS2, CYP27A1 MEN1 1731/4885KMT2A 4385/4885CYP3A4 718/4885
US-20110028437-A1 PHOSPHORYLATED PYRONE ANALOGS AND METHODS PCK1, PC, PCK2 MEN1 4072/4885KMT2A 3401/4885CYP3A4 708/4885
US-20100144612-A1 PHOSPHORYLATED PYRONE ANALOGS AND METHODS PCK1, PC, PCK2 MEN1 4072/4885KMT2A 3401/4885CYP3A4 708/4885
US-20100204089-A1 PHOSPHORYLATED PYRONE ANALOGS AND METHODS PCK1, PC, PCK2 MEN1 4072/4885KMT2A 3401/4885CYP3A4 708/4885
US-20110190514-A1 PYRONE ANALOG COMPOSITIONS AND METHODS CYP11B2, CYP11B1, GLS2 MEN1 535/4885KMT2A 4673/4885CYP3A4 718/4885
US-20090082400-A1 SOLUBLE PYRONE ANALOGS METHODS AND COMPOSITIONS PGF, ABCG2, PYGB MEN1 3857/4885KMT2A 4497/4885CYP3A4 111/4885

“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.

Send feedback