SCHEMBL17543206

SCHEMBL17543206

Cc1ccc(N2CCC3(CC2)CO3)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
FFAR4 Q5NUL3 1/20 0.40
MAPT P10636 3/20 0.38
GAA P10253 1/20 0.38
CYP3A4 P08684 2/20 0.37
HTR1A P08908 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP1A2 P05177 1/20 0.37
HTR3A P46098 1/20 0.37
KDM4E B2RXH2 1/20 0.37
RAD52 P43351 1/20 0.37
ALDH1A1 P00352 4/20 0.37
POLB P06746 1/20 0.37
ADRB2 P07550 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KMT2A Q03164 2/20 0.36
PHGDH O43175 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL17543711 0.83 SMN1; SMN2 (0.50) SMN1; SMN2MAPTGAAHTR1AKDM4E
SCHEMBL14804169 0.83 LGMN (0.45) SMN1; SMN2MAPTGAAKDM4EALDH1A1
SCHEMBL17542688 0.81 SMN1; SMN2 (0.41) SMN1; SMN2MAPTGAAALDH1A1POLB
SCHEMBL17543628 0.80 HTR1A (0.39) SMN1; SMN2MAPTGAAHTR1AKDM4E
SCHEMBL17543212 0.80 CHRM1 (0.42) SMN1; SMN2MAPTGAAKDM4ERAD52
SCHEMBL17543577 0.80 ALDH1A1 (0.42) SMN1; SMN2MAPTGAAHTR1AHTR3A
SCHEMBL17542945 0.79 AKR1C3 (0.50) SMN1; SMN2MAPTGAAKDM4EALDH1A1
SCHEMBL17542795 0.78 SIGMAR1 (0.40) SMN1; SMN2MAPTGAACYP2D6CYP2C9
SCHEMBL24123846 0.77 FFAR4 (0.48) BCHEFFAR4MAPTCYP3A4HTR1A
SCHEMBL8910816 0.77 BCHE (0.42) BCHESMN1; SMN2FFAR4MAPTGAA

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 BCHE 1701/4885SMN1; SMN2 4767/4885FFAR4 4026/4885
US-10464926-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis FNTB, SLC11A2, TBCD BCHE 1701/4885SMN1; SMN2 4767/4885FFAR4 4026/4885
US-20180312488-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS FNTB, SLC11A2, TBCD BCHE 1701/4885SMN1; SMN2 4767/4885FFAR4 4026/4885

“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.