SCHEMBL17543013

SCHEMBL17543013

Fc1cc(Cl)c(OC(F)(F)F)cc1N1CCC2(CC1)CO2

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 10/20 0.40
SLC6A2 P23975 3/20 0.37
SLC6A4 P31645 3/20 0.37
SLC6A3 Q01959 3/20 0.37
DRD3 P35462 1/20 0.33
PDE3A Q14432 1/20 0.33
PGK1 P00558 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
NOTUM Q6P988 1/20 0.32
PPOX P50336 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL17543677 0.90 FFAR4 (0.43) FFAR4DRD3PDE3APGK1SMN1; SMN2
SCHEMBL17542743 0.86 NPC1 (0.37) FFAR4SLC6A2SLC6A4SLC6A3DRD3
SCHEMBL17543333 0.84 PPOX (0.45) FFAR4SLC6A2SLC6A4SLC6A3SMN1; SMN2
SCHEMBL17543413 0.84 SLC6A2 (0.37) FFAR4SLC6A2SLC6A4SLC6A3PPOX
SCHEMBL17542810 0.81 PPOX (0.47) FFAR4SLC6A2SLC6A4SLC6A3PPOX
SCHEMBL17543434 0.81 PPOX (0.47) FFAR4SLC6A2SLC6A4SLC6A3PPOX
SCHEMBL17543463 0.81 SMN1; SMN2 (0.38) FFAR4SLC6A2SLC6A4SLC6A3PDE3A
SCHEMBL17543443 0.80 PPOX (0.38) SLC6A2SLC6A4SLC6A3DRD3PPOX
SCHEMBL17543218 0.79 PPOX (0.49) SLC6A2SLC6A4SLC6A3SMN1; SMN2PPOX
SCHEMBL17542792 0.78 POLB (0.44) FFAR4SLC6A2SLC6A4SLC6A3SMN1; SMN2

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 6 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
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 (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-10053446-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis FNTB, SLC11A2, TBCD FFAR4 4026/4885SLC6A2 1308/4885SLC6A4 3031/4885
US-10464926-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis FNTB, SLC11A2, TBCD FFAR4 4026/4885SLC6A2 1308/4885SLC6A4 3031/4885
US-20180312488-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS FNTB, SLC11A2, TBCD FFAR4 4026/4885SLC6A2 1308/4885SLC6A4 3031/4885

“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.