SCHEMBL2417272

SCHEMBL2417272

CC(=O)Oc1cc(=O)oc2cc(O)c(O)cc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.59
ALDH1A1 P00352 5/20 0.59
GLA P06280 5/20 0.59
GAA P10253 5/20 0.59
HSD17B10 Q99714 4/20 0.59
MAPT P10636 3/20 0.59
CASP1 P29466 3/20 0.59
CASP7 P55210 3/20 0.59
HPGD P15428 2/20 0.59
HSP90AA1 P07900 1/20 0.59
HSP90AB1 P08238 1/20 0.59
ALPG P10696 1/20 0.59
ALOX15 P16050 1/20 0.59
ALOX12 P18054 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
MCL1 Q07820 7/20 0.56
AKR1B1 P15121 3/20 0.56
CYP3A4 P08684 1/20 0.56
THRB P10828 1/20 0.56
CELA1 Q9UNI1 2/20 0.55

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
SCHEMBL27886617 0.83 KDM4E (0.66) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL2122340 0.81 HSD17B3 (0.58) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL3724696 0.79 KDM4E (0.78) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL27594508 0.76 MCL1 (0.54) KDM4EALDH1A1GAAHSD17B10HPGD
SCHEMBL246219 0.76 KDM4E (0.62) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL6266846 0.74 KDM4E (1.00) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL28068602 0.74 MET (0.59) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL17667609 0.74 CUL4A (0.46) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL6365673 0.73 MCL1 (0.68) KDM4EALDH1A1GLAGAAHSD17B10
4-Methylesculetin SCHEMBL29361762 0.72 MCL1 (1.00) KDM4EALDH1A1GLAGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673983-B2 Melanins synthesized chemically or via enzyme catalysis LOYOLA UNIVERSITY CHICAGO (US) 2014-03-18 US claimed
US-20110230562-A1 MELANINS SYNTHESIZED CHEMICALLY OR VIA ENZYME CATALYSIS LOYOLA UNIVERSITY CHICAGO 2011-09-22 US claimed
EP-2256170-B1 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications XEROX CORP (US) 2014-12-24 EP disclosed
US-8673983-B2 Melanins synthesized chemically or via enzyme catalysis LOYOLA UNIVERSITY CHICAGO (US) 2014-03-18 US disclosed
US-8334026-B2 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications XEROX CORPORATION (US) 2012-12-18 US disclosed
US-20110230562-A1 MELANINS SYNTHESIZED CHEMICALLY OR VIA ENZYME CATALYSIS LOYOLA UNIVERSITY CHICAGO 2011-09-22 US disclosed
US-20100304040-A1 TUNABLE FLUORESCENT UV CURABLE GEL INKS CONTAINING FLUORESCENT MONOMERS FOR FOOD PACKAGING APPLICATIONS XEROX CORPORATION (US) 2010-12-02 US disclosed
EP-2256170-A1 Tunable fluorescent UV curable gel inks containing fluorescent monomers for food packaging applications Xerox Corporation (US) 2010-12-01 EP disclosed
WO-2009082735-A1 MELANINS SYNTHESIZED CHEMICALLY OR VIA ENZYME CATALYSIS UNIVERSITY OF CHICAGO (US) 2009-07-02 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-20110230562-A1 MELANINS SYNTHESIZED CHEMICALLY OR VIA ENZYME CATALYSIS TYR, TH, MAOA KDM4E 1642/4885ALDH1A1 337/4885GLA 134/4885

“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.