SCHEMBL17544019

SCHEMBL17544019

Fc1ccc(OCCOc2cc(N3CCC4(CC3)CO4)c(F)cc2Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.39
SLC6A4 P31645 4/20 0.39
SLC6A3 Q01959 3/20 0.39
LMNA P02545 4/20 0.37
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 1/20 0.37
HTR1A P08908 5/20 0.36
DRD2 P14416 4/20 0.36
HTR2A P28223 4/20 0.36
DRD3 P35462 4/20 0.36
DRD1 P21728 3/20 0.36
DRD5 P21918 2/20 0.36
HRH1 P35367 2/20 0.36
HTR7 P34969 1/20 0.36
HTR2B P41595 1/20 0.36
PPARA Q07869 1/20 0.36
MAPT P10636 1/20 0.35
NLRP1 Q9C000 1/20 0.35
PPOX P50336 1/20 0.35

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
SCHEMBL17542663 0.87 ALDH1A1 (0.37) SLC6A2SLC6A4SLC6A3LMNAALDH1A1
SCHEMBL17542792 0.85 POLB (0.44) SLC6A2SLC6A4SLC6A3ALDH1A1SMN1; SMN2
SCHEMBL17543443 0.85 PPOX (0.38) SLC6A2SLC6A4SLC6A3ALDH1A1DRD2
SCHEMBL17543218 0.84 PPOX (0.49) SLC6A2SLC6A4SLC6A3SMN1; SMN2HTT
SCHEMBL17542810 0.82 PPOX (0.47) SLC6A2SLC6A4SLC6A3ALDH1A1HTT
SCHEMBL17543849 0.81 CHEK1 (0.44) SLC6A2SLC6A4SLC6A3HTR2AMAPT
SCHEMBL17543303 0.81 PPOX (0.41) LMNAALDH1A1SMN1; SMN2HTTHTR1A
SCHEMBL17543413 0.80 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3PPOXFFAR4
SCHEMBL17543685 0.79 PPOX (0.39) SLC6A2SLC6A4SLC6A3SMN1; SMN2PPOX
SCHEMBL17543333 0.78 PPOX (0.45) SLC6A2SLC6A4SLC6A3LMNAALDH1A1

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-10464926-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-11-05 US disclosed
EP-3186240-B1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2019-06-12 EP disclosed
US-20180312488-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2018-11-01 US disclosed
US-10053446-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2018-08-21 US disclosed
US-20170253576-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-09-07 US disclosed
EP-3186240-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS Otsuka Pharmaceutical Co., Ltd. (JP) 2017-07-05 EP disclosed
WO-2016031255-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-03-03 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 (4 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-10053446-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis FNTB, SLC11A2, TBCD SLC6A2 1308/4885SLC6A4 3031/4885SLC6A3 1578/4885
US-10464926-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis FNTB, SLC11A2, TBCD SLC6A2 1308/4885SLC6A4 3031/4885SLC6A3 1578/4885
US-20180312488-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS FNTB, SLC11A2, TBCD SLC6A2 1308/4885SLC6A4 3031/4885SLC6A3 1578/4885
US-20170253576-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS FNTB, SLC11A2, TBCD SLC6A2 1308/4885SLC6A4 3031/4885SLC6A3 1578/4885

“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.