SCHEMBL2725503

SCHEMBL2725503

COc1cc(B2OC(C)(C)C(C)(C)O2)cc(C(F)(F)F)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.39
SNCA P37840 1/20 0.36
LPL P06858 4/20 0.35
LIPG Q9Y5X9 4/20 0.35
DGAT1 O75907 1/20 0.34
KDM4E B2RXH2 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 1/20 0.33
F2 P00734 1/20 0.32
F11 P03951 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
FFAR1 O14842 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
BLM P54132 1/20 0.32
CA1 P00915 1/20 0.31

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
SCHEMBL14678296 0.87 LPL (0.41) HSD17B10SNCALPLLIPGF2
SCHEMBL13468302 0.86 DGAT1 (0.40) GAALPLLIPGDGAT1FFAR1
SCHEMBL23086884 0.86 AAK1 (0.35) HSD17B10GAALPLLIPGDGAT1
SCHEMBL25408676 0.86 PTGS1 (0.33) HSD17B10LPLLIPGAAK1
SCHEMBL17667880 0.84 LPL (0.44) SNCALPLLIPGDGAT1KDM4E
SCHEMBL17667900 0.83 LPL (0.36) HSD17B10LPLLIPGF2F11
SCHEMBL25407721 0.82 PTGS1 (0.40)
SCHEMBL2326400 0.81 HSP90AA1 (0.42) HSD17B10LPLLIPGKDM4EL3MBTL1
SCHEMBL13468753 0.81 LPL (0.37) HSD17B10SNCALPLLIPGDGAT1
SCHEMBL1674073 0.81 LPL (0.40) HSD17B10SNCALPLLIPGF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10668067-B2 Pyridine sulfonamides AMGEN INC. (US) 2020-06-02 US disclosed
US-20190167682-A1 PYRIDINE SULFONAMIDES AMGEN INC. (US) 2019-06-06 US disclosed
EP-2635279-A2 CHEMICAL COMPOUNDS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2013-09-11 EP disclosed
US-20130225524-A1 Chemical Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2013-08-29 US disclosed
WO-2012061557-A2 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2012-05-10 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 (3 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-20130225524-A1 Chemical Compounds LDHA, NQO2, LDHB HSD17B10 136/4885GAA 387/4885SNCA 4551/4885
US-20190167682-A1 PYRIDINE SULFONAMIDES TRPV1, TRPA1, TRPV5 HSD17B10 3893/4885GAA 3562/4885SNCA 1160/4885
US-10668067-B2 Pyridine sulfonamides TRPV1, TRPA1, TRPV5 HSD17B10 3893/4885GAA 3562/4885SNCA 1160/4885

“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.