SCHEMBL16832441

SCHEMBL16832441

O=C(O)c1cc(C(=O)O)c2c(F)cc(F)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ASPH Q12797 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ KDM8 Q8N371 1/20 0.46
▸ KEAP1 Q14145 2/20 0.39
▸ NFE2L2 Q16236 1/20 0.39
▸ ALOX15 P16050 2/20 0.37
▸ HIF1A Q16665 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CES2 O00748 1/20 0.35
▸ CES1 P23141 1/20 0.35
▸ KMO O15229 1/20 0.35
▸ IGFBP5 P24593 1/20 0.34
▸ SLC2A1 P11166 1/20 0.33
▸ SLC2A2 P11168 1/20 0.33
▸ SLC2A3 P11169 1/20 0.33
▸ SLC2A4 P14672 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ GPR17 Q13304 1/20 0.33
▸ DHODH Q02127 1/20 0.33
▸ GAA P10253 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
SCHEMBL16832598 0.89 GRM2 (0.42) ASPHKDM4EKDM8KEAP1NFE2L2
SCHEMBL16832509 0.79 KDM4E (0.45) ASPHKDM4EKDM8KEAP1NFE2L2
SCHEMBL16833296 0.75 NQO2 (0.56) KDM4EALDH1A1GAAMEN1LMNA
SCHEMBL9379284 0.75 PKM (0.40) KDM4EALOX15ALDH1A1HPGDHSD17B10
SCHEMBL16833015 0.73 DHODH (0.48) ASPHKDM4EKDM8KEAP1IGFBP5
SCHEMBL30659832 0.73 DHODH (0.48) ASPHKDM4EKDM8KEAP1IGFBP5
SCHEMBL16832306 0.72 ASPH (0.49) ASPHKDM4EKDM8KEAP1NFE2L2
SCHEMBL16832147 0.72 NQO2 (0.60) SLC2A1SLC2A2SLC2A3SLC2A4
SCHEMBL31117248 0.71 TSHR (0.61) ASPHKDM4EKDM8KEAP1NFE2L2
SCHEMBL7370184 0.71 DHODH (0.60) ASPHKDM4EKDM8KEAP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170037028-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-02-09 — — US disclosed
EP-3083598-A1 GLUCOSE TRANSPORT INHIBITORS Bayer Pharma Aktiengesellschaft (DE) 2016-10-26 — — EP disclosed
WO-2015091428-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-06-25 — — 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-20170037028-A1 GLUCOSE TRANSPORT INHIBITORS SLC2A1, SLC2A2, SLC2A4 ASPH 2330/4885KDM4E 3458/4885KDM8 4221/4885

“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.

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