SCHEMBL2415783

SCHEMBL2415783

CCOc1cc(B2OC(C)(C)C(C)(C)O2)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPL P06858 9/20 0.44
LIPG Q9Y5X9 9/20 0.44
AAK1 Q2M2I8 1/20 0.41
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
EGFR P00533 2/20 0.37
HIF1A Q16665 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
XBP1 P17861 1/20 0.36

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
SCHEMBL14036018 0.87 LPL (0.48) LPLLIPGAAK1KMT2AALDH1A1
SCHEMBL182626 0.86 LPL (0.47) LPLLIPGAAK1HIF1ACA1
SCHEMBL15969034 0.85 AAK1 (0.40) LPLLIPGAAK1EGFRHIF1A
SCHEMBL23363649 0.84 AAK1 (0.48) LPLLIPGAAK1EGFRHIF1A
SCHEMBL29899181 0.84 AAK1 (0.48) LPLLIPGAAK1EGFRHIF1A
SCHEMBL22408211 0.83 ALDH1A1 (0.53) LPLLIPGKMT2AALDH1A1HIF1A
SCHEMBL18252684 0.83 LPL (0.45) LPLLIPGHIF1ACA1CA2
SCHEMBL21358661 0.83 AAK1 (0.39) LPLLIPGAAK1KMT2AALDH1A1
SCHEMBL858457 0.83 CSF1R (0.45) LPLLIPGAAK1EGFRCA1
SCHEMBL22816088 0.82 HTR2C (0.38) LPLLIPGAAK1EGFRHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676779-B2 Small molecule CFTR correctors DISCOVERYBIOMED, INC. (US) 2017-06-13 US disclosed
CN-102884047-B 2-pyridone compounds NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-11-25 CN disclosed
US-20150299206-A1 SMALL MOLECULE CFTR CORRECTORS DISCOVERYBIOMED, INC. (US) 2015-10-22 US disclosed
US-8822503-B2 2-pyridone compounds TAISHO PHARMACEUTICAL CO., LTD (JP) 2014-09-02 US disclosed
WO-2014081820-A1 SMALL MOLECULE CFTR CORRECTORS DISCOVERYBIOMED, INC. (US) 2014-05-30 WO disclosed
EP-2508513-A1 2-PYRIDONE COMPOUNDS Taisho Pharmaceutical Co., Ltd. (JP) 2012-10-10 EP disclosed
US-20110237791-A1 2-PYRIDONE COMPOUNDS TAISHO PHARMACEUTICAL CO., LTD (JP) 2011-09-29 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 (2 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-20110237791-A1 2-PYRIDONE COMPOUNDS PDXK, HK1, KCNJ2 LPL 1883/4885LIPG 3808/4885AAK1 122/4885
US-20150299206-A1 SMALL MOLECULE CFTR CORRECTORS CFTR, CLCN2, SLC26A4 LPL 1799/4885LIPG 2400/4885AAK1 4034/4885

“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.