SCHEMBL903262

SCHEMBL903262

CCOC(=O)CC1OC(C)O1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.44
GAA P10253 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
ALDH1A1 P00352 3/20 0.41
TRPA1 O75762 1/20 0.41
CYP1A2 P05177 2/20 0.36
LMNA P02545 3/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX15 P16050 1/20 0.34
SOAT1 P35610 1/20 0.34
MIF P14174 1/20 0.34
KMT2A Q03164 1/20 0.34
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PPP1CC P36873 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL10274709 0.85 GAA (0.48) MGAMGAASIMGAM2ALDH1A1
SCHEMBL13884554 0.82 ALDH1A1 (0.34) ALDH1A1TSHR
SCHEMBL12284783 0.80 ALDH1A1 (0.43) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4904207 0.77 MGAM (0.46) MGAMGAASIMGAM2ALDH1A1
SCHEMBL9577787 0.77 GAA (0.46) MGAMGAASIMGAM2ALDH1A1
Methane SCHEMBL4902707 0.75 MGAM (0.44) MGAMGAASIMGAM2ALDH1A1
SCHEMBL12017279 0.74 ALDH1A1 (0.38) MGAMGAASIMGAM2ALDH1A1
SCHEMBL14079942 0.74 GAA (0.36) MGAMGAASIMGAM2ALDH1A1
SCHEMBL14079889 0.74 ALDH1A1 (0.36) MGAMGAASIMGAM2ALDH1A1
SCHEMBL27298747 0.72 MGAM (0.41) MGAMGAASIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2489656-A1 Selective androgen receptor modulators (sarms) and uses thereof Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2012041862-A1 APOPTOSIS IMAGING AGENTS BASED ON LANTIBIOTIC PEPTIDES GE HEALTHCARE LIMITED (GB) 2012-04-05 WO disclosed
US-8022085-B2 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2011-09-20 US disclosed
US-20110105498-A1 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof AMGEN INC. (US) 2011-05-05 US disclosed
WO-2011043387-A1 PYRAZOLOXAZOLE COMPOUND エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) 2011-04-14 WO disclosed
WO-2009082437-A9 SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) AND USES THEREOF LIGAND PHARMACEUTICALS INCORPORATED (US) 2010-08-12 WO disclosed
WO-2010037533-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO KGAA (DE) 2010-04-08 WO disclosed
WO-2010030967-A1 4-ARYLOXYQUINOLIN-2(1H)-ONES AS MTOR KINASE AND PI3 KINASE INHIBITORS, FOR USE AS ANTI-CANCER AGENTS WYETH LLC (US) 2010-03-18 WO disclosed
WO-2009146034-A2 MAPK/ERK KINASE INHIBITORS AND METHODS OF USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-03 WO disclosed
WO-2009082437-A2 SELECTIVE ANDROGEN RECEPTOR MODULATORS (SARMS) AND USES THEREOF LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-07-02 WO disclosed
WO-2008136948-A1 PYRAZOLO-PYRIDINONE AND PYRAZOLO-PYRAZINONE COMPOUNDS AS P38 MODULATORS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE AMGEN INC. (US) 2008-11-13 WO disclosed
WO-2008137176-A1 PYRAZOLO-PYRIDINONE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE AMGEN INC. (US) 2008-11-13 WO disclosed
WO-2008127274-A2 HETEROCYCLIC INHIBITORS OF BACTERIAL PEPTIDYL TRNA HYDROLASE AND USES THEREOF PTC THERAPEUTICS, INC. (US) 2008-10-23 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-20110105498-A1 Pyrazolo-pyridinone and pyrazolo-pyrazinone compounds as P38 modulators and methods of use thereof MAPK1, MAP4K2, MAP3K1 MGAM 4882/4885GAA 4729/4885SI 4852/4885

“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.