SCHEMBL16833342

SCHEMBL16833342

COC(=O)c1cc(C(=O)OC)c2cc(Cl)c(F)cc2n1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 10/20 0.53
KDM4E B2RXH2 1/20 0.45
ALPL P05186 1/20 0.40
PLA2G2A P14555 5/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL16832739 0.91 NQO2 (0.60) NQO2KDM4EALPL
SCHEMBL16832948 0.88 NQO2 (0.52) NQO2KDM4EPLA2G2AL3MBTL1ALDH1A1
SCHEMBL16832671 0.84 NQO2 (0.49) NQO2KDM4EPLA2G2AL3MBTL1ALDH1A1
SCHEMBL16832382 0.83 NQO2 (0.48) NQO2KDM4EPLA2G2AL3MBTL1ALDH1A1
SCHEMBL2907647 0.81 NQO2 (0.44) NQO2KDM4EALPLL3MBTL1ALDH1A1
SCHEMBL28100421 0.80 NQO2 (0.44) NQO2KDM4EPLA2G2AL3MBTL1ALDH1A1
SCHEMBL16832968 0.79 NQO2 (0.66) NQO2KDM4EPLA2G2AL3MBTL1
SCHEMBL16832648 0.77 PLA2G2A (0.63) NQO2KDM4EPLA2G2AL3MBTL1ALDH1A1
SCHEMBL16832684 0.77 CHEK1 (0.54) NQO2KDM4EPLA2G2AL3MBTL1SMN1; SMN2
SCHEMBL16832481 0.77 PLA2G2A (0.63) NQO2KDM4EPLA2G2AL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170226081-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-08-10 US disclosed
US-20170210738-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-07-27 US disclosed
EP-3172192-A1 GLUCOSE TRANSPORT INHIBITORS Bayer Pharma Aktiengesellschaft (DE) 2017-05-31 EP disclosed
EP-3172194-A1 GLUCOSE TRANSPORT INHIBITORS Bayer Pharma Aktiengesellschaft (DE) 2017-05-31 EP disclosed
US-20170037028-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-02-09 US disclosed
WO-2016202935-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-22 WO disclosed
EP-3083598-A1 GLUCOSE TRANSPORT INHIBITORS Bayer Pharma Aktiengesellschaft (DE) 2016-10-26 EP disclosed
WO-2016012474-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-01-28 WO disclosed
WO-2016012481-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-01-28 WO 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 (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-20170226081-A1 GLUCOSE TRANSPORT INHIBITORS SLC2A1, SLC2A2, SLC2A4 NQO2 338/4885KDM4E 3458/4885ALPL 3147/4885
US-20170037028-A1 GLUCOSE TRANSPORT INHIBITORS SLC2A1, SLC2A2, SLC2A4 NQO2 338/4885KDM4E 3458/4885ALPL 3147/4885
US-20170210738-A1 GLUCOSE TRANSPORT INHIBITORS SLC2A1, SLC2A2, SLC2A4 NQO2 293/4885KDM4E 3214/4885ALPL 3139/4885

“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.