SCHEMBL17397885

SCHEMBL17397885

CC1(C)OB(c2c(C=O)ccc3c2OCCO3)OC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.33
▸ ERN1 O75460 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL17397884 0.88 GSK3B (0.36) ERN1ALDH1A1HPGDHSD17B10
SCHEMBL20861758 0.83 ERN1 (0.35) ERN1MAPK1
SCHEMBL15077376 0.77 MEN1 (0.39) ERN1ALDH1A1
SCHEMBL17397897 0.77 KDM4E (0.33) KDM4EALDH1A1HPGDHTTHSD17B10
SCHEMBL17397866 0.73 LMNA (0.37) KDM4EERN1ALDH1A1HPGDHSD17B10
SCHEMBL12665647 0.72 ALDH1A1 (0.46) ERN1ALDH1A1
SCHEMBL29458861 0.72 ALDH1A1 (0.46) ERN1ALDH1A1
SCHEMBL29398633 0.71 TDP1 (0.37) ERN1ALDH1A1
SCHEMBL13073970 0.71 ERN1 (0.46) ERN1ALDH1A1
SCHEMBL12468157 0.71 ERN1 (0.43) ERN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3164404-B1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS DAIICHI SANKYO CO LTD (JP) 2019-04-03 — — EP disclosed
EP-3164404-B1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS DAIICHI SANKYO CO LTD (JP) 2019-04-03 — — EP disclosed
US-9944660-B2 Tricyclic benzoxaboroles as antibacterial agents DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-04-17 — — US disclosed
US-9944660-B2 Tricyclic benzoxaboroles as antibacterial agents DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-04-17 — — US disclosed
US-9944660-B2 Tricyclic benzoxaboroles as antibacterial agents DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-04-17 — — US disclosed
US-20170174709-A1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-06-22 — — US disclosed
US-20170174709-A1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-06-22 — — US disclosed
US-20170174709-A1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-06-22 — — US disclosed
EP-3164404-A1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-05-10 — — EP disclosed
WO-2016001834-A1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-01-07 — — WO disclosed
WO-2016001834-A1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-01-07 — — 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-20170174709-A1 TRICYCLIC BENZOXABOROLES AS ANTIBACTERIAL AGENTS REN, ALPI, IKBKE KDM4E 3131/4885ERN1 907/4885ALDH1A1 2153/4885

“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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