SCHEMBL18984664

SCHEMBL18984664

O=Cc1ccc2c(c1OS(=O)(=O)C(F)(F)F)CCC2

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DRD2 P14416 3/20 0.32
HTR1D P28221 3/20 0.32
DRD3 P35462 3/20 0.32
METAP2 P50579 2/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL1506665 0.76 DRD2 (0.37) DRD2HTR1DDRD3
SCHEMBL9085508 0.76 HTR2A (0.35) MEN1KMT2ADRD2HTR1DDRD3
SCHEMBL837149 0.74 KMT2A (0.56) MEN1KMT2ACA1CA2
SCHEMBL19330608 0.74 CXCR2 (0.38) DRD2HTR1DDRD3METAP2
SCHEMBL19249620 0.73 DRD2 (0.35) DRD2HTR1DDRD3
SCHEMBL12533492 0.71 DRD2 (0.38) DRD2HTR1DDRD3
SCHEMBL6411328 0.71 CXCR2 (0.40) DRD2HTR1DDRD3METAP2
SCHEMBL7030007 0.71 DRD2 (0.41) DRD2HTR1DDRD3
SCHEMBL3113928 0.71 DRD2 (0.53) DRD2HTR1DDRD3
SCHEMBL1506403 0.70 STS (0.34) MEN1KMT2ADRD2HTR1DDRD3

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 8 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

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 MEN1 4515/4885KMT2A 3883/4885DRD2 4675/4885

“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.